SCHEMBL11075331

SCHEMBL11075331

CCOC(=O)CCc1ccccc1N

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.69
CYP4A11 Q02928 3/20 0.69
ALDH1A1 P00352 4/20 0.52
GAA P10253 1/20 0.52
HSD17B10 Q99714 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.49
MAPT P10636 1/20 0.47
EPHX2 P34913 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
LMNA P02545 2/20 0.45
PTPN1 P18031 1/20 0.45
KDM4E B2RXH2 1/20 0.44
CDYL Q9Y232 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
ALOX5 P09917 1/20 0.43

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
Hydrochloric Acid SCHEMBL11263678 0.98 CYP4F2 (0.67) CYP4F2CYP4A11ALDH1A1GAAHSD17B10
SCHEMBL4270902 0.90 CYP4F2 (0.64) CYP4F2CYP4A11ALDH1A1GAAHSD17B10
SCHEMBL27567553 0.89 CYP4F2 (0.71) CYP4F2CYP4A11ALDH1A1GAAHSD17B10
SCHEMBL9713399 0.88 CYP4F2 (0.69) CYP4F2CYP4A11ALDH1A1GAAHSD17B10
SCHEMBL11404769 0.88 CYP4F2 (0.69) CYP4F2CYP4A11ALDH1A1GAAHSD17B10
SCHEMBL69660 0.88 CYP4F2 (0.86) CYP4F2CYP4A11ALDH1A1GAAHSD17B10
SCHEMBL5201213 0.87 CYP4F2 (0.53) CYP4F2CYP4A11ALDH1A1HSD17B10LMNA
SCHEMBL1067476 0.87 CYP4F2 (0.60) CYP4F2CYP4A11ALDH1A1GAAHSD17B10
SCHEMBL11214621 0.86 CYP4F2 (0.59) CYP4F2CYP4A11ALDH1A1GAAHSD17B10
SCHEMBL11867095 0.86 CYP4F2 (0.59) CYP4F2CYP4A11ALDH1A1GAAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3224258-B1 4,5,6,7-TETRAHYDRO-1H-PYRAZOLO[4,3-C]PYRIDIN-3-AMINE COMPOUNDS AS CBP AND/OR EP300 INHIBITORS GENENTECH INC (US) 2019-08-14 EP disclosed
CN-1168727-C Substituted benzimidazole ���ĵ�˹ҩ��¹����޹�˾ 2004-09-29 CN disclosed
CN-1356995-A Substituted benzimidazole AVENTIS PHARMA GMBH (DE) 2002-07-03 CN disclosed
US-4440940-A HYPOLIPIDEMIC AND ANTIATHEROSCLEROTIC AGENTS AMERICAN CYANAMID COMPANY (US) 1984-04-03 US disclosed