SCHEMBL6598413

SCHEMBL6598413

O=C1NC(=O)c2c(CCCO)cccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 3/20 0.43
CCNE2 O96020 2/20 0.43
CDK4 P11802 2/20 0.43
CCND1 P24385 2/20 0.43
CCNE1 P24864 2/20 0.43
CDK2 P24941 2/20 0.43
GAA P10253 2/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
GSK3B P49841 2/20 0.41
PARP1 P09874 1/20 0.39
WEE1 P30291 3/20 0.39
GSK3A P49840 1/20 0.38
CDK5 Q00535 1/20 0.38
CDK5R1 Q15078 1/20 0.38
CASP3 P42574 6/20 0.38
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL7403092 0.95 KDM4E (0.42) KDM4EALDH1A1CCNE2CDK4CCND1
SCHEMBL8967453 0.94 KDM4E (0.41) KDM4EALDH1A1CCNE2CDK4CCND1
SCHEMBL31035989 0.94 KDM4E (0.41) KDM4EALDH1A1CCNE2CDK4CCND1
SCHEMBL28249127 0.94 KDM4E (0.41) KDM4EALDH1A1CCNE2CDK4CCND1
SCHEMBL17633986 0.94 KDM4E (0.41) KDM4EALDH1A1CCNE2CDK4CCND1
SCHEMBL1424202 0.90 KDM4E (0.45) KDM4EALDH1A1CCNE2CDK4CCND1
Water SCHEMBL10733874 0.88 KDM4E (0.44) KDM4EALDH1A1CCNE2CDK4CCND1
SCHEMBL11015946 0.88 GSK3B (0.45) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL10914947 0.88 GSK3B (0.45) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL11206986 0.88 GSK3B (0.45) KDM4EALDH1A1GAAHPGDHSD17B10

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119119846-B Environment-friendly coating for environment-friendly building outer wall and preparation method thereof 中亿丰建设集团股份有限公司 2025-05-30 CN disclosed
CN-119119846-B Environment-friendly coating for environment-friendly building outer wall and preparation method thereof 中亿丰建设集团股份有限公司 2025-05-30 CN disclosed
CN-119119846-A Environment-friendly coating for environment-friendly building outer wall and preparation method thereof 中亿丰建设集团股份有限公司 2024-12-13 CN disclosed
CN-119119846-A Environment-friendly coating for environment-friendly building outer wall and preparation method thereof 中亿丰建设集团股份有限公司 2024-12-13 CN disclosed
EP-1169320-B1 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG CHEM INVESTMENT LTD (KR) 2004-09-22 EP disclosed
US-6511978-B1 For treating cancer, restenosis, atherosclerosis or viral infections LG LIFE SCIENCES, LTD. (KR) 2003-01-28 US disclosed
EP-1169320-A4 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG CHEM INVESTMENT LTD (KR) 2002-10-30 EP disclosed
EP-1169320-A1 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG Chem Investment, Ltd. (KR) 2002-01-09 EP disclosed
US-6214834-B1 ANGIOGENESIS INHIBITORS; ANTIINFLAMMATORY AGENTS; ANTICANCER AGENTS DUPONT PHARMACEUTICALS COMPANY 2001-04-10 US disclosed
WO-2000064891-A1 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG CHEM INVESTMENT LTD. (KR) 2000-11-02 WO disclosed
WO-1998043962-A1 HETEROCYCLIC INTEGRIN INHIBITOR PRODRUGS DU PONT PHARMACEUTICALS COMPANY (US) 1998-10-08 WO disclosed
US-5760028-A TREATING CANCER METASTASIS, DIABETIC RETINOPATHY, NEOVASCULAR GLAUCOMA, THROMBOSIS, RESTENOSIS, OSTEOPOROSIS, MACULAR DEGENERATION THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) 1998-06-02 US disclosed