SCHEMBL3265449

SCHEMBL3265449

Cc1ccc(NC(=O)Nc2ccc(-c3noc(C(=O)N[C@](C)(C(=O)O)C(C)C)n3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
SCN10A Q9Y5Y9 1/20 0.44
CSGALNACT1 Q8TDX6 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
TP53 P04637 2/20 0.41
RXFP1 Q9HBX9 1/20 0.41
MAPT P10636 3/20 0.41
PIK3CA P42336 1/20 0.41
MTOR P42345 1/20 0.41
PIK3CG P48736 1/20 0.41
ALDH1A1 P00352 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 2/20 0.40
POLB P06746 1/20 0.40
TSHR P16473 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
SCHEMBL3266083 0.84 CSGALNACT1 (0.51) KDM4ECSGALNACT1SMN1; SMN2MAPTPIK3CA
SCHEMBL3265094 0.83 KDM4E (0.52) KDM4EGAASCN10ASMN1; SMN2TP53
SCHEMBL2296375 0.79 CSGALNACT1 (0.65) CSGALNACT1
SCHEMBL3265779 0.79 KDM4E (0.46) KDM4EGAATP53MAPTNPC1
SCHEMBL2296367 0.79 CSGALNACT1 (0.65) CSGALNACT1
SCHEMBL3265444 0.77 CSGALNACT1 (0.54) CSGALNACT1SMN1; SMN2MAPTLMNATSHR
SCHEMBL2296821 0.76 CSGALNACT1 (0.53) SCN10ACSGALNACT1SMN1; SMN2TP53MAPT
SCHEMBL2296824 0.76 CSGALNACT1 (0.53) SCN10ACSGALNACT1SMN1; SMN2TP53MAPT
SCHEMBL2299081 0.72 DGAT1 (0.56) CSGALNACT1
SCHEMBL2299953 0.70 CSGALNACT1 (0.66) CSGALNACT1

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-2010023609-A1 OXAZOLE, OXADIAZOLE AND THIAZOLE DERIVATIVES AS DIACYLGLYCEROL ACYLTRANFERASE INHIBITORS PIRAMAL LIFE SCIENCES LIMITED (IN) 2010-03-04 WO claimed