SCHEMBL7530767

SCHEMBL7530767

CCO/C(=C/c1ccc(OCCN2C(=O)COc3ccccc32)cc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
ALDH1A1 P00352 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
HSD17B10 Q99714 3/20 0.44
PPARG P37231 2/20 0.44
PPARA Q07869 2/20 0.44
POLB P06746 1/20 0.44
TSHR P16473 1/20 0.43
TP53 P04637 1/20 0.43
OPRK1 P41145 1/20 0.42
MAPT P10636 1/20 0.42
CBX7 O95931 1/20 0.41
CDYL2 Q8N8U2 1/20 0.41
CDYL Q9Y232 1/20 0.41
CDY1; CDY1B Q9Y6F8 1/20 0.41
USP2 O75604 1/20 0.41
HTT P42858 1/20 0.41
SMPD1 P17405 1/20 0.41
ALOX12 P18054 1/20 0.41

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
SCHEMBL5112985 1.00 MEN1 (0.52) MEN1KMT2AALDH1A1L3MBTL1HSD17B10
SCHEMBL5112991 1.00 MEN1 (0.52) MEN1KMT2AALDH1A1L3MBTL1HSD17B10
SCHEMBL14265701 0.93 MEN1 (0.52) MEN1KMT2AALDH1A1L3MBTL1HSD17B10
SCHEMBL6003755 0.86 PPARA (0.57) MEN1KMT2APPARGPPARAPOLB
SCHEMBL6003752 0.86 PPARA (0.57) MEN1KMT2APPARGPPARAPOLB
SCHEMBL6004647 0.86 PPARA (0.57) MEN1KMT2APPARGPPARAPOLB
SCHEMBL5140361 0.82 MAPT (0.46) KMT2AALDH1A1PPARGPPARAPOLB
SCHEMBL5107495 0.82 MAPT (0.46) KMT2AALDH1A1PPARGPPARAPOLB
SCHEMBL5107504 0.82 MAPT (0.46) KMT2AALDH1A1PPARGPPARAPOLB
SCHEMBL5107272 0.80 L3MBTL1 (0.51) MEN1KMT2AALDH1A1L3MBTL1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002543194-A 2002-12-17 JP claimed
CN-1353699-A Substituted bicyclic heterocycles, process for their preparation and their use as antiobesity and hypocholesterolemic agents REDDY RESEARCH FOUNDATION (IN) 2002-06-12 CN claimed
EP-1175412-A1 SUBSTITUTED BICYCLIC HETEROCYCLES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTIOBESITY AND HYPOCHOLESTEROLEMIC AGENTS Dr. Reddy's Research Foundation (IN) 2002-01-30 EP claimed
WO-2000066572-A1 SUBSTITUTED BICYCLIC HETEROCYCLES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTIOBESITY AND HYPOCHOLESTEROLEMIC AGENTS DR. REDDY'S RESEARCH FOUNDATION (IN) 2000-11-09 WO claimed
CN-1353699-A Substituted bicyclic heterocycles, process for their preparation and their use as antiobesity and hypocholesterolemic agents REDDY RESEARCH FOUNDATION (IN) 2002-06-12 CN disclosed
EP-1175412-A1 SUBSTITUTED BICYCLIC HETEROCYCLES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTIOBESITY AND HYPOCHOLESTEROLEMIC AGENTS Dr. Reddy's Research Foundation (IN) 2002-01-30 EP disclosed
EP-1082313-A1 BICYCLIC COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S RESEARCH FOUNDATION (IN) 2001-03-14 EP disclosed
WO-2000066572-A1 SUBSTITUTED BICYCLIC HETEROCYCLES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTIOBESITY AND HYPOCHOLESTEROLEMIC AGENTS DR. REDDY'S RESEARCH FOUNDATION (IN) 2000-11-09 WO disclosed
WO-1999020614-A1 BICYCLIC COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S RESEARCH FOUNDATION (IN) 1999-04-29 WO disclosed