SCHEMBL736600

SCHEMBL736600

O=c1[nH]cnc2sc3c(c12)CCCC3

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 1.00
KMT2A Q03164 2/20 1.00
CHEK1 O14757 1/20 1.00
TSHR P16473 1/20 1.00
GAA P10253 3/20 0.97
NPSR1 Q6W5P4 1/20 0.94
ALDH1A1 P00352 4/20 0.56
TP53 P04637 1/20 0.56
HSD17B10 Q99714 1/20 0.56
CYP1A2 P05177 1/20 0.54
HIF1A Q16665 1/20 0.54
KDM4E B2RXH2 3/20 0.52
MAPT P10636 2/20 0.52
RXFP1 Q9HBX9 2/20 0.52
MEN1 O00255 1/20 0.52
HPGD P15428 2/20 0.52
GLA P06280 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
BRD4 O60885 4/20 0.51

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
SCHEMBL914710 0.98 GAA (1.00) HTTKMT2ACHEK1TSHRGAA
SCHEMBL916128 0.97 NPSR1 (1.00) HTTKMT2ACHEK1TSHRGAA
SCHEMBL915757 0.81 HTT (0.68) HTTKMT2ACHEK1TSHRGAA
SCHEMBL4694133 0.80 HTT (0.67) HTTKMT2ACHEK1TSHRGAA
SCHEMBL3637702 0.80 HTT (0.67) HTTKMT2ACHEK1TSHRGAA
SCHEMBL6031412 0.79 GAA (0.68) HTTKMT2ACHEK1TSHRGAA
SCHEMBL4691404 0.79 HTT (0.65) HTTKMT2ACHEK1TSHRGAA
SCHEMBL2951788 0.78 NPSR1 (0.68) HTTKMT2ACHEK1TSHRGAA
SCHEMBL14459794 0.78 HTT (0.63) HTTKMT2ACHEK1TSHRGAA
SCHEMBL939440 0.78 KDM4E (0.64) HTTKMT2ACHEK1TSHRGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240352031-A1 Thieno[2,3-D]pyrimidin-4-one Derivatives as NMDAR Modulators and Uses Related Thereto UNIV EMORY (US) 2024-10-24 US disclosed
US-12006328-B2 Thieno[2,3-d]pyrimidin-4-one derivatives as NMDAR modulators and uses related thereto EMORY UNIVERSITY (US) 2024-06-11 US disclosed
US-20210254056-A1 IDENTIFICATION AND TARGETED MODULATION OF GENE SIGNALING NETWORKS CAMP4 THERAPEUTICS CORPORATION 2021-08-19 US disclosed
US-10751320-B2 Therapeutic agents containing cannabis flavonoid derivatives for the prevention and treatment of neurodegenerative disorders LOTHERA, LLC 2020-08-25 US disclosed
US-20190192691-A1 REGULATED BIOCIRCUIT SYSTEMS OBSIDIAN THERAPEUTICS, INC. 2019-06-27 US disclosed
US-9981981-B2 Tricyclic proteasome activity enhancing compounds PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2018-05-29 US disclosed
US-9981981-B2 Tricyclic proteasome activity enhancing compounds PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2018-05-29 US disclosed
EP-2595993-B1 TRICYCLIC PROTEASOME ACTIVITY ENHANCING COMPOUNDS HARVARD COLLEGE (US) 2018-04-18 EP disclosed
EP-2276346-B1 FUSED BICYCLIC PYRIMIDINE COMPOUNDS AS AURORA KINASE INHIBITORS NAT HEALTH RESEARCH INSTITUTES (TW) 2016-11-23 EP disclosed
EP-2276346-B1 FUSED BICYCLIC PYRIMIDINE COMPOUNDS AS AURORA KINASE INHIBITORS NAT HEALTH RESEARCH INSTITUTES (TW) 2016-11-23 EP disclosed
US-20090275533-A1 FUSED BICYCLIC PYRIMIDINE COMPOUNDS AS AURORA KINASE INHIBITORS NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-11-05 US disclosed
US-20090275533-A1 FUSED BICYCLIC PYRIMIDINE COMPOUNDS AS AURORA KINASE INHIBITORS NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-11-05 US disclosed
US-20090275533-A1 FUSED BICYCLIC PYRIMIDINE COMPOUNDS AS AURORA KINASE INHIBITORS NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-11-05 US disclosed
WO-2009109983-A1 THIENO[2,3-D]-PYRIMIDINE-4(3H)-ONE COMPOUNDS WITH ANTIFUNGAL PROPERTIES AND PROCESS THEREOF NATIONAL CHEMICAL LABORATORY (IN) 2009-09-11 WO disclosed
WO-2008117269-A2 HETEROTRI CYCIII C COMPOUNDS AS SEROTONERGIC AND/OR DOPAMINERGIC AGENTS AND USES THEREOF ATIR HOLDING S.A. (LU) 2008-10-02 WO disclosed
US-20060258651-A1 Use of heterocyclic compounds as scce inhibitors QUANTUM LTO HOLDINGS, LLC 2006-11-16 US disclosed
EP-1631295-A2 USE OF FUSED HETEROCYCLIC COMPOUNDS AS SCCE INHIBITORS FOR THE TREATMENT OF SKIN CONDITIONS OR CANCER Arexis AB (SE) 2006-03-08 EP disclosed
US-6849638-B2 4-AMINO-5,6-SUBSTITUTED THIOPHENO [2,3-D] PYRIMIDINES, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME, AND THEIR USE IN THE TREATMENT OR PREVENTION OF PDE7B-MEDIATED DISEASES AND CONDITIONS BAYER PHARMACEUTICALS CORPORATION (US) 2005-02-01 US disclosed
WO-2004108139-A2 USE OF FUSED HETEROCYCLIC COMPOUNDS AS SCCE INHIBITORS FOR THE TREATMENT OF SKIN CONDITIONS OR CANCER AREXIS AB (SE) 2004-12-16 WO disclosed
WO-2002002568-A1 PYRIMIDINE DERIVATIVES AND THEIR USE FOR PREVENTING AND TREATING CEREBRAL ISCHAEMIA KNOLL GMBH (DE) 2002-01-10 WO 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 (5 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-20090275533-A1 FUSED BICYCLIC PYRIMIDINE COMPOUNDS AS AURORA KINASE INHIBITORS AURKB, AURKA, AURKC HTT 4842/4885KMT2A 1082/4885CHEK1 45/4885
US-20060258651-A1 Use of heterocyclic compounds as scce inhibitors RCE1, CTSE, SPINT2 HTT 3172/4885KMT2A 2584/4885CHEK1 89/4885
US-12006328-B2 Thieno[2,3-d]pyrimidin-4-one derivatives as NMDAR modulators and uses related thereto GRIN2A, GRIN3A, GRIN1 HTT 498/4885KMT2A 369/4885CHEK1 806/4885
US-10751320-B2 Therapeutic agents containing cannabis flavonoid derivatives for the prevention and treatment of neurodegenerative disorders NCSTN, CHLSN, CNTN1 HTT 7/4885KMT2A 2826/4885CHEK1 3041/4885
US-20240352031-A1 Thieno[2,3-D]pyrimidin-4-one Derivatives as NMDAR Modulators and Uses Related Thereto GRIN2A, GRIN3A, GRIN1 HTT 498/4885KMT2A 369/4885CHEK1 806/4885

“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.