SCHEMBL3249363

SCHEMBL3249363

CCC1Oc2ccccc2NC1=O

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.62
ALDH1A1 P00352 3/20 0.55
HSD17B10 Q99714 2/20 0.55
MAPK1 P28482 1/20 0.55
HPGD P15428 1/20 0.55
GAA P10253 1/20 0.52
TP53 P04637 2/20 0.51
USP2 O75604 2/20 0.51
MAPT P10636 1/20 0.51
THRB P10828 1/20 0.51
TSHR P16473 1/20 0.51
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50

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
SCHEMBL4821188 0.87 PARP1 (0.58) PARP1ALDH1A1HSD17B10MAPK1HPGD
SCHEMBL5670690 0.84 PARP1 (0.55) PARP1ALDH1A1HSD17B10MAPK1HPGD
SCHEMBL26472774 0.82 PARP1 (0.57) PARP1ALDH1A1HSD17B10MAPK1HPGD
SCHEMBL5670684 0.82 HSD17B10 (0.53) PARP1ALDH1A1HSD17B10MAPK1HPGD
SCHEMBL3641415 0.81 PARP1 (0.56) PARP1ALDH1A1HSD17B10MAPK1HPGD
SCHEMBL5670577 0.80 L3MBTL1 (0.58) PARP1ALDH1A1HSD17B10MAPK1HPGD
SCHEMBL7551218 0.80 KMT2A (0.47) PARP1ALDH1A1HSD17B10MAPK1GAA
SCHEMBL5670687 0.80 ALDH1A1 (0.56) PARP1ALDH1A1HSD17B10MAPK1HPGD
SCHEMBL5671330 0.80 PARP1 (0.54) PARP1ALDH1A1HSD17B10MAPK1HPGD
SCHEMBL26123017 0.80 ALDH1A1 (0.56) PARP1ALDH1A1HSD17B10MAPK1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4076459-A1 PRMT5 INHIBITORS Merck Sharp & Dohme LLC (US) 2022-10-26 EP claimed
US-20240374607-A1 MEDICAMENT FOR PREVENTING AND/OR TREATING DRY EYE SANTEN PHARMACEUTICAL CO., LTD. (JP) 2024-11-14 US disclosed
WO-2023180189-A1 MPRO TARGETING ANTIVIRAL COMPOUNDS EXSCIENTIA AI LIMITED (GB) 2023-09-28 WO disclosed
EP-4076459-A1 PRMT5 INHIBITORS Merck Sharp & Dohme LLC (US) 2022-10-26 EP disclosed
CN-110840847-B Pharmaceutical compositions for the treatment of cystic fibrosis transmembrane conductance regulator mediated diseases 沃泰克斯药物股份有限公司 2022-07-29 CN disclosed
US-7842686-B2 CGRP receptor antagonists VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-11-30 US disclosed
US-7842686-B2 CGRP receptor antagonists VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-11-30 US disclosed
US-7842686-B2 CGRP receptor antagonists VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-11-30 US disclosed
EP-2049532-B1 CGRP RECEPTOR ANTAGONISTS VERTEX PHARMA (US) 2010-06-02 EP disclosed
EP-2049532-B1 CGRP RECEPTOR ANTAGONISTS VERTEX PHARMA (US) 2010-06-02 EP disclosed
EP-2049532-A1 CGRP RECEPTOR ANTAGONISTS Vertex Pharmaceuticals, Inc. (US) 2009-04-22 EP disclosed
WO-2008011190-A1 CGRP RECEPTOR ANTAGONISTS VERTEX PHARMACEUTICALS INCORPORATED (US) 2008-01-24 WO disclosed
WO-2008011190-A1 CGRP RECEPTOR ANTAGONISTS VERTEX PHARMACEUTICALS INCORPORATED (US) 2008-01-24 WO disclosed
EP-0980362-B1 SUBSTITUTED HETEROCYCLES AND THEIR USE IN MEDICAMENTS SCHERING AG (DE) 2006-08-16 EP disclosed
US-6191127-B1 ANTIINFLAMMATORY AGENTS, AUTOIMMUNE DISEASES, CARDIOVASCULAR DISORDERS, NERVOUS SYSTEM DISORDERS SCHERING AKTIENGESELLSCHAFT (DE) 2001-02-20 US disclosed
EP-0980362-A1 SUBSTITUTED HETEROCYCLES AND THEIR USE IN MEDICAMENTS SCHERING AKTIENGESELLSCHAFT (DE) 2000-02-23 EP disclosed
WO-1998050372-A1 SUBSTITUTED HETEROCYCLES AND THEIR USE IN MEDICAMENTS SCHERING AKTIENGESELLSCHAFT (DE) 1998-11-12 WO disclosed
EP-0120589-B1 IMIDAZO-HETEROCYCLIC COMPOUNDS, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-06-08 EP disclosed
US-4621084-A CARDIOTONIC, ANTIULCER FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-11-04 US disclosed
EP-0120589-A1 Imidazo-heterocyclic compounds, processes for preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-10-03 EP 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-20240374607-A1 MEDICAMENT FOR PREVENTING AND/OR TREATING DRY EYE HMGCR, OSBP, OSBPL3 PARP1 4509/4885ALDH1A1 1169/4885HSD17B10 2029/4885

“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.