SCHEMBL3232020

SCHEMBL3232020

CCOC(=O)c1cc(-c2ccc(N)c(C)c2)no1.CCOC(=O)c1cc(-c2ccc(NC(=O)Nc3c(F)cccc3F)c(C)c2)no1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CSGALNACT1 Q8TDX6 7/20 0.41
RAB9A P51151 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
KDM4E B2RXH2 2/20 0.40
RXFP1 Q9HBX9 1/20 0.40
MAPT P10636 6/20 0.36
NPC1 O15118 1/20 0.36
NLRP3 Q96P20 1/20 0.36
TP53 P04637 1/20 0.36
HPGD P15428 1/20 0.35
LMNA P02545 2/20 0.35
HTT P42858 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL2294225 0.95 CSGALNACT1 (0.44) CSGALNACT1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL3227996 0.89 CSGALNACT1 (0.47) CSGALNACT1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL2296373 0.83 CSGALNACT1 (0.51) CSGALNACT1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL2293743 0.82 CSGALNACT1 (0.49) CSGALNACT1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL2297766 0.82 KDM4E (0.43) RAB9AMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL2296615 0.78 CSGALNACT1 (0.49) CSGALNACT1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL2296703 0.78 CSGALNACT1 (0.53) CSGALNACT1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL2294779 0.78 MAPT (0.42) RAB9AMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL2298873 0.76 CSGALNACT1 (0.55) CSGALNACT1
SCHEMBL2298617 0.76 RAB9A (0.57) CSGALNACT1RAB9AMEN1KMT2ASMN1; SMN2

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 disclosed