SCHEMBL2516355

SCHEMBL2516355

Sc1nnc(-c2ccco2)o1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 13/20 0.59
RAB9A P51151 13/20 0.59
HPGD P15428 11/20 0.59
KDM4E B2RXH2 10/20 0.59
HSD17B10 Q99714 9/20 0.59
ALDH1A1 P00352 9/20 0.59
SMN1; SMN2 Q16637 8/20 0.54
MAPT P10636 5/20 0.54
TSHR P16473 5/20 0.54
TP53 P04637 5/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2C19 P33261 1/20 0.54
POLB P06746 2/20 0.48
APAF1 O14727 1/20 0.48
NSD2 O96028 1/20 0.48
CACNA1B Q00975 1/20 0.48
APBA1 Q02410 1/20 0.48
SAE1 Q9UBE0 1/20 0.48
UBA2 Q9UBT2 1/20 0.48
GAA P10253 2/20 0.46

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
SCHEMBL6624611 0.76 RAB9A (0.59) NPC1RAB9AHPGDKDM4EHSD17B10
SCHEMBL1852694 0.76 NPC1 (0.59) NPC1RAB9AHPGDKDM4EHSD17B10
SCHEMBL1520979 0.72 RAB9A (0.54) NPC1RAB9AHPGDKDM4EHSD17B10
SCHEMBL18910899 0.72 RAB9A (0.56) NPC1RAB9AHPGDKDM4EHSD17B10
SCHEMBL18470454 0.72 KDM4E (0.54) NPC1RAB9AHPGDKDM4EHSD17B10
SCHEMBL17344108 0.72 KDM4E (0.54) NPC1RAB9AHPGDKDM4EHSD17B10
SCHEMBL28531488 0.72 ALDH1A1 (0.56) NPC1RAB9AHPGDKDM4EHSD17B10
SCHEMBL28975871 0.72 NPC1 (0.54) NPC1RAB9AHPGDKDM4EHSD17B10
SCHEMBL13930840 0.71 RAB9A (0.72) NPC1RAB9AHPGDKDM4EHSD17B10
SCHEMBL13930787 0.71 KDM4E (1.00) NPC1RAB9AHPGDKDM4EHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9925193-B2 Thioether derivatives as protein kinase inhibitors PROQINASE GMBH (DE) 2018-03-27 US disclosed
US-9925193-B2 Thioether derivatives as protein kinase inhibitors PROQINASE GMBH (DE) 2018-03-27 US disclosed
US-9925193-B2 Thioether derivatives as protein kinase inhibitors PROQINASE GMBH (DE) 2018-03-27 US disclosed
EP-2922857-B1 THIOETHER DERIVATIVES AS PROTEIN KINASE INHIBITORS PROQINASE GMBH (DE) 2018-01-03 EP disclosed
US-20150328219-A1 THIOETHER DERIVATIVES AS PROTEIN KINASE INHIBITORS PROQINASE GMBH (DE) 2015-11-19 US disclosed
US-20150328219-A1 THIOETHER DERIVATIVES AS PROTEIN KINASE INHIBITORS PROQINASE GMBH (DE) 2015-11-19 US disclosed
US-20150328219-A1 THIOETHER DERIVATIVES AS PROTEIN KINASE INHIBITORS PROQINASE GMBH (DE) 2015-11-19 US disclosed
US-8623111-B2 Methods for creating a moist top dressing material and products related thereto BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2014-01-07 US disclosed
US-20120234219-A1 Sand Based Fungicides Board of Regents of Michigan State University 2012-09-20 US disclosed
US-8202343-B2 Sand based fungicides BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2012-06-19 US disclosed
EP-1551835-A1 NOVEL 1,4-DIAZABICYCLOALKANE DERIVATIVES, THEIR PREPARATION AND USE NeuroSearch A/S (DK) 2005-07-13 EP disclosed
WO-2004029053-A1 NOVEL 1,4-DIAZABICYCLOALKANE DERIVATIVES, THEIR PREPARATION AND USE NEUROSEARCH A/S (DK) 2004-04-08 WO disclosed
US-RE35754-E FOR TREATING BACTERIAL INFECTIONS HOECHST AKTIENGESELLSCHAFT (DE) 1998-03-24 US disclosed
US-5710146-A ANTIBIOTICS FOR BACTERICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1998-01-20 US disclosed
US-5089490-A Cephem derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1992-02-18 US disclosed
US-4861787-A Nematicidal compositions CIBA-GEIGY CORPORATION (US) 1989-08-29 US disclosed
US-4758556-A Cephem derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1988-07-19 US disclosed
EP-0263066-A2 2-Mercapto-oxadiazole and -thiadiazole derivatives, process for their preparation and nematicides containing them CIBA-GEIGY AG (CH) 1988-04-06 EP disclosed
US-4713319-A STORAGE STABILITY; ANTIFOGGING AGENTS; HIGH IMAGE DENSITY; PHOTOTHERMOGRAPHY FUJI PHOTO FILM CO., LTD. (JP) 1987-12-15 US disclosed
US-4278793-A ANTIBIOTICS, BACTERICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1981-07-14 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 (1 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-20150328219-A1 THIOETHER DERIVATIVES AS PROTEIN KINASE INHIBITORS MAP3K1, MAP3K6, MAP3K20 NPC1 2721/4885RAB9A 2427/4885HPGD 2346/4885

“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.