SCHEMBL3230912

SCHEMBL3230912

COCC(N/C(=N\O)c1cc(-c2ccc(Nc3nc4ccc(F)cc4s3)cc2)no1)C(=O)OC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 2/20 0.45
CSGALNACT1 Q8TDX6 1/20 0.45
MAPT P10636 7/20 0.43
SMN1; SMN2 Q16637 6/20 0.43
HPGD P15428 4/20 0.43
LMNA P02545 4/20 0.43
KDM4E B2RXH2 3/20 0.43
GAA P10253 3/20 0.43
MEN1 O00255 3/20 0.43
HTT P42858 3/20 0.43
KMT2A Q03164 3/20 0.43
TNF P01375 2/20 0.43
MCL1 Q07820 2/20 0.43
NOD1 Q9Y239 2/20 0.43
NR2F2 P24468 1/20 0.43
KLF5 Q13887 1/20 0.43
NPC1 O15118 6/20 0.41
RAB9A P51151 6/20 0.41
ALDH1A1 P00352 3/20 0.41
ALPL P05186 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
SCHEMBL2299974 1.00 DGAT1 (0.45) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD
SCHEMBL2299985 1.00 DGAT1 (0.45) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD
SCHEMBL2299980 1.00 DGAT1 (0.45) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD
SCHEMBL3238703 0.94 CSGALNACT1 (0.49) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD
SCHEMBL2293676 0.94 CSGALNACT1 (0.49) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD
SCHEMBL2293683 0.94 CSGALNACT1 (0.49) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD
SCHEMBL2293690 0.94 CSGALNACT1 (0.49) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD
SCHEMBL2300902 0.93 MAPT (0.42) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD
SCHEMBL2300895 0.93 MAPT (0.42) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD
SCHEMBL2300897 0.93 MAPT (0.42) DGAT1CSGALNACT1MAPTSMN1; SMN2HPGD

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