SCHEMBL2280669

SCHEMBL2280669

CC1(C(=O)O)CCCC1N1Cc2ccc(-c3ccc(Nc4ccc(C(F)(F)F)cc4)cc3)cc2C1=O

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 4/20 0.37
MCHR1 Q99705 2/20 0.35
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
KARS1 Q15046 1/20 0.35
OPRD1 P41143 1/20 0.35
TRPV1 Q8NER1 1/20 0.34
TDP2 O95551 1/20 0.34
APP P05067 1/20 0.34
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
BRD4 O60885 1/20 0.34
CREBBP Q92793 1/20 0.34
FPR2 P25090 2/20 0.34
MGLL Q99685 1/20 0.34
NAMPT P43490 1/20 0.34
APOB P04114 1/20 0.34
MTTP P55157 1/20 0.34
FPR1 P21462 1/20 0.34

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
SCHEMBL2279512 0.84 MCHR1 (0.39) DGAT1MCHR1OPRD1TRPV1TDP2
SCHEMBL2280666 0.79 DGAT1 (0.39) DGAT1MCHR1OPRD1TDP2BRD4
SCHEMBL2196468 0.78 MCHR1 (0.39) DGAT1MCHR1TDP2BRD4CREBBP
SCHEMBL2196467 0.78 MCHR1 (0.39) DGAT1MCHR1TDP2BRD4CREBBP
SCHEMBL2197280 0.77 DGAT1 (0.41) DGAT1MCHR1BRD4CREBBPFPR2
SCHEMBL2198162 0.77 TDP2 (0.42) DGAT1TDP2APPBRD4CREBBP
SCHEMBL2279505 0.76 SCN1A (0.39) MCHR1BRD4CREBBPAPOBMTTP
SCHEMBL2198200 0.75 MCHR1 (0.36) MCHR1BRD4CREBBPFPR2APOB
SCHEMBL2296052 0.72 SDCBP (0.43) DGAT1BRD4CREBBP
SCHEMBL2356973 0.71 DGAT1 (0.53) DGAT1MCHR1POLB

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
EP-2519500-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE Piramal Healthcare Ltd. (IN) 2012-11-07 EP disclosed
WO-2011080718-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE PIRAMAL LIFE SCIENCES LIMITED (IN) 2011-07-07 WO disclosed