SCHEMBL6073211

SCHEMBL6073211

CCOC(=O)CN(Cc1ccc(OCCN2C(=O)COc3ccccc32)cc1)C(=O)Oc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.51
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 3/20 0.46
TSHR P16473 2/20 0.46
MAPT P10636 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SMPD1 P17405 1/20 0.45
PPARA Q07869 5/20 0.43
PPARG P37231 4/20 0.43
HSD17B10 Q99714 2/20 0.43
TP53 P04637 1/20 0.43
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

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
SCHEMBL6073548 0.93 OPRK1 (0.48) OPRK1MEN1KMT2AALDH1A1TSHR
SCHEMBL6073615 0.92 OPRK1 (0.48) OPRK1MEN1KMT2AALDH1A1TSHR
SCHEMBL6073010 0.90 OPRK1 (0.51) OPRK1MEN1KMT2AALDH1A1TSHR
SCHEMBL6073497 0.90 OPRK1 (0.46) OPRK1MEN1KMT2AALDH1A1TSHR
SCHEMBL6073183 0.85 NPSR1 (0.52) ALDH1A1TSHRMAPTPPARAPPARG
SCHEMBL14360396 0.81 PPARA (0.44) OPRK1ALDH1A1TSHRMAPTL3MBTL1
SCHEMBL6073002 0.81 NPSR1 (0.51) OPRK1ALDH1A1TSHRMAPTPPARA
SCHEMBL6073520 0.79 NPSR1 (0.49) ALDH1A1TSHRMAPTPPARAPPARG
SCHEMBL6073165 0.79 NPSR1 (0.49) ALDH1A1TSHRMAPTPPARAPPARG
SCHEMBL6073297 0.77 NPSR1 (0.47) ALDH1A1TSHRMAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006117743-A1 SUBSTITUTED AROMATIC COMPOUNDS AS ANTIDIABETIC AGENTS RANBAXY LABORATORIES LIMITED (IN) 2006-11-09 WO claimed
WO-2006117743-A1 SUBSTITUTED AROMATIC COMPOUNDS AS ANTIDIABETIC AGENTS RANBAXY LABORATORIES LIMITED (IN) 2006-11-09 WO disclosed