SCHEMBL24245

SCHEMBL24245

[c]1cccc(-c2cc3ccccc3s2)c1SCc1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP3A4 P08684 1/20 0.34
STK17B O94768 2/20 0.34
STK17A Q9UEE5 2/20 0.34
CAMKK1 Q8N5S9 1/20 0.34
AURKB Q96GD4 1/20 0.34
CAMKK2 Q96RR4 1/20 0.34
PIM2 Q9P1W9 1/20 0.34
NPY2R P49146 1/20 0.34
HIPK4 Q8NE63 1/20 0.34
CYP19A1 P11511 1/20 0.33
HSD17B1 P14061 1/20 0.33
HSD17B2 P37059 1/20 0.33
RPA1 P27694 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17438680 0.76 S100A4 (0.38) NPC1RAB9ASMN1; SMN2HSD17B2S100A4
SCHEMBL17438712 0.76 RAB9A (0.47) NPC1RAB9ASMN1; SMN2S100A4
SCHEMBL3787647 0.75 MAOA (0.33) NPC1RAB9ASMN1; SMN2NQO1NQO2
SCHEMBL1247110 0.74 TDP1 (0.40) NPC1RAB9ASMN1; SMN2CYP3A4S100A4
SCHEMBL324177 0.72 MAOB (0.44) NPC1RAB9ASMN1; SMN2
SCHEMBL29710475 0.71 APP (0.54) APPNPC1RAB9ASMN1; SMN2CYP3A4
SCHEMBL6981693 0.71 LMNA (0.39) NPC1RAB9ASMN1; SMN2CYP3A4
SCHEMBL1724293 0.70 ELANE (0.35) NPC1RAB9ASMN1; SMN2CYP3A4S100A4
SCHEMBL15952376 0.70 ALDH1A1 (0.33) CYP3A4
SCHEMBL19133572 0.70 APP (0.57) APPCYP19A1HSD17B1HSD17B2CA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 475 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240216380-A1 BTK Inhibitors to Treat Solid Tumors Through Modulation of the Tumor Microenvironment ACERTA PHARMA BV (NL) 2024-07-04 US disclosed
US-20240197738-A1 COMPOUND 7AI IN TREATING EWING SARCOMA BY INHIBITING OTUD7A Atomwise Inc. 2024-06-20 US disclosed
US-20240197742-A1 Therapeutic Combinations of a CD19 Inhibitor and a BTK Inhibitor ACERTA PHARMA BV (NL) 2024-06-20 US disclosed
US-20240180904-A1 Methods of Treating Chronic Lymphocytic Leukemia and Small Lymphocytic Leukemia Using a BTK Inhibitor ACERTA PHARMA BV (NL) 2024-06-06 US disclosed
WO-2024119099-A1 GALLIUM-SALOPHEN ANTIMICROBIAL COMPOUNDS AND METHODS OF USE THEREOF UNIVERSITY OF MARYLAND, BALTIMORE (US) 2024-06-06 WO disclosed
US-20240174630-A1 SELECTIVE HISTONE DEACETYLASE INHIBITORS FOR THE TREATMENT OF HUMAN DISEASE SHUTTLE PARMACEUTICALS, LLC 2024-05-30 US disclosed
EP-4370109-A1 SUBEROYLANILIDE HYDROXAMIC ACID (SAHA) DRUGS, CONJUGATES, AND NANOPARTICLES, AND METHODS OF USE THEREOF University of Maryland, Baltimore (US) 2024-05-22 EP disclosed
WO-2024097204-A1 GRAFTABLE BIOCIDAL LINKERS AND POLYMERS AND USES THEREOF DEBOGY MOLECULAR, INC. (US) 2024-05-10 WO disclosed
US-20240150315-A1 BETA-2 ADRENORECEPTOR MODULATORS AND METHODS OF USING SAME THOMAS JEFFERSON UNIVERSITY 2024-05-09 US disclosed
US-20240140940-A1 CARBOXYLIC ACID, ACYL SULFONAMIDE AND ACYL SULFAMIDE-DERIVATIZED BICYCLIC AZA-HETEROAROMATICS AS SELECTIVE MCL-1 INHIBITORS AND AS DUAL MCL-1/BCL-2 INHIBITORS UNIVERSITY OF MARYLAND, BALTIMORE 2024-05-02 US disclosed
US-7393869-B2 Methods of using thiazolidine derivatives to treat cancer or inflammation QLT INC. (CA) 2008-07-01 US disclosed
US-20080153815-A1 PINANE-SUBSTITUTED PYRIMIDINEDIAMINE DERIVATIVES USEFUL AS AXL INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2008-06-26 US disclosed
US-7335658-B2 Pyridazine derivatives and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2008-02-26 US disclosed
US-20070087363-A1 Therapeutic methods, compounds and compositions MYRIAD GENETICS, INCORPORATED (US) 2007-04-19 US disclosed
US-20060252767-A1 Piperazine derivatives and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2006-11-09 US disclosed
US-20060205713-A1 Antidiabetic agents; disease of glucose tolerance; insulin resistance; obesity; dyslipidemia; metabolic disorders; liver disorders; [4-(6-Phenethyloxy-pyridazin-3-yl)piperazin-1-yl]-(2-trifluoromethyl-phenyl)-methanone; stearoyl-CoA desaturase modulators XENON PHARMACEUTICALS INC. (CA) 2006-09-14 US disclosed
US-20060183782-A1 Methods of using thiazolidine derivatives to treat cancer or inflammation QLT INC. (CA) 2006-08-17 US disclosed
US-20050065143-A1 Pyridazine derivatives and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2005-03-24 US disclosed
US-20040180921-A1 Substituted imidazo[1,2-a]pyridine derivatives MUTEL VINCENT (FR) 2004-09-16 US disclosed
US-6355641-B1 HYPOTENSIVE AGENTS AND WOUND HEALING AGENTS SYNTEX (U.S.A.) LLC 2002-03-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (14 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050065143-A1 Pyridazine derivatives and their use as therapeutic agents PRDX5, SNRPD3, SNRPD2 APP 2058/4885NPC1 797/4885RAB9A 44/4885
US-20240150315-A1 BETA-2 ADRENORECEPTOR MODULATORS AND METHODS OF USING SAME ADRB2, ADRB1, ADRA2A APP 912/4885NPC1 2494/4885RAB9A 3269/4885
US-20240140940-A1 CARBOXYLIC ACID, ACYL SULFONAMIDE AND ACYL SULFAMIDE-DERIVATIZED BICYCLIC AZA-HETEROAROMATICS AS SELECTIVE MCL-1 INHIBITORS AND AS DUAL MCL-1/BCL-2 INHIBITORS MCL1, BCLAF1, BCL2A1 APP 4784/4885NPC1 3155/4885RAB9A 4106/4885
US-20240216380-A1 BTK Inhibitors to Treat Solid Tumors Through Modulation of the Tumor Microenvironment BTK, LYN, SYK APP 4017/4885NPC1 3117/4885RAB9A 1801/4885
US-20240180904-A1 Methods of Treating Chronic Lymphocytic Leukemia and Small Lymphocytic Leukemia Using a BTK Inhibitor BTK, LYN, SYK APP 4553/4885NPC1 4239/4885RAB9A 2800/4885
US-20060183782-A1 Methods of using thiazolidine derivatives to treat cancer or inflammation PTPN2, PTPRCAP, PTPN5 APP 4602/4885NPC1 2614/4885RAB9A 4072/4885
US-20240174630-A1 SELECTIVE HISTONE DEACETYLASE INHIBITORS FOR THE TREATMENT OF HUMAN DISEASE HDAC1, HDAC2, HDAC5 APP 3182/4885NPC1 1920/4885RAB9A 3285/4885
US-20040180921-A1 Substituted imidazo[1,2-a]pyridine derivatives GRM5, GRM1, GRIK5 APP 3695/4885NPC1 413/4885RAB9A 982/4885
US-20240197742-A1 Therapeutic Combinations of a CD19 Inhibitor and a BTK Inhibitor BTK, CD274, BCL9 APP 2721/4885NPC1 3240/4885RAB9A 1056/4885
US-20060252767-A1 Piperazine derivatives and their use as therapeutic agents ARG2, S1PR5, S1PR1 APP 2109/4885NPC1 127/4885RAB9A 53/4885
US-20070087363-A1 Therapeutic methods, compounds and compositions APP, BACE1, PSEN1 APP 1/4885NPC1 31/4885RAB9A 1976/4885
US-20080153815-A1 PINANE-SUBSTITUTED PYRIMIDINEDIAMINE DERIVATIVES USEFUL AS AXL INHIBITORS AXL, TYRO3, MERTK APP 1776/4885NPC1 3839/4885RAB9A 2279/4885
US-20060205713-A1 Antidiabetic agents; disease of glucose tolerance; insulin resistance; obesity; dyslipidemia; metabolic disorders; liver disorders; [4-(6-Phenethyloxy-pyridazin-3-yl)piperazin-1-yl]-(2-trifluoromethyl-phenyl)-methanone; stearoyl-CoA desaturase modulators GPR119, SCD, CPT1A APP 3676/4885NPC1 239/4885RAB9A 597/4885
US-20240197738-A1 COMPOUND 7AI IN TREATING EWING SARCOMA BY INHIBITING OTUD7A OTUD7B, USP7, UBQLN1 APP 3340/4885NPC1 3984/4885RAB9A 441/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.