SCHEMBL6073548

SCHEMBL6073548

CCOC(=O)CN(Cc1ccc(OCCN2C(=O)COc3ccccc32)cc1)C(=O)Oc1cccc(C)c1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 2/20 0.48
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
CBX7 O95931 1/20 0.42
CDYL2 Q8N8U2 1/20 0.42
CDYL Q9Y232 1/20 0.42
CDY1; CDY1B Q9Y6F8 1/20 0.42
SMPD1 P17405 1/20 0.42
TSHR P16473 2/20 0.42
HSD17B10 Q99714 2/20 0.42
ALDH1A1 P00352 3/20 0.41
MAPT P10636 3/20 0.41
TP53 P04637 2/20 0.40
CHRM1 P11229 1/20 0.40
POLB P06746 1/20 0.39

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
SCHEMBL6073211 0.93 OPRK1 (0.51) OPRK1KMT2AMEN1L3MBTL1CBX7
SCHEMBL6073497 0.91 OPRK1 (0.46) OPRK1KMT2AMEN1L3MBTL1CBX7
SCHEMBL6073615 0.87 OPRK1 (0.48) OPRK1KMT2AMEN1L3MBTL1SMPD1
SCHEMBL6073010 0.83 OPRK1 (0.51) OPRK1KMT2AMEN1L3MBTL1CBX7
SCHEMBL6073297 0.79 NPSR1 (0.47) L3MBTL1TSHRALDH1A1MAPT
SCHEMBL6073183 0.78 NPSR1 (0.52) TSHRHSD17B10ALDH1A1MAPT
SCHEMBL6073238 0.77 NPSR1 (0.45) KMT2ATSHRALDH1A1MAPT
SCHEMBL14360396 0.77 PPARA (0.44) OPRK1L3MBTL1TSHRALDH1A1MAPT
SCHEMBL6073002 0.76 NPSR1 (0.51) OPRK1TSHRHSD17B10ALDH1A1MAPT
SCHEMBL6073520 0.75 NPSR1 (0.49) TSHRALDH1A1MAPT

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 1 patent. 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 disclosed