SCHEMBL2181507

SCHEMBL2181507

CCOc1ccccc1C(=O)Nc1ccc(-c2ccc3c(c2)C(=O)N(C(C(=O)OC)C(C)C)C3)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 2/20 0.46
TP53 P04637 3/20 0.46
RAB9A P51151 2/20 0.45
KCNK3 O14649 1/20 0.45
KCNK9 Q9NPC2 1/20 0.45
POLB P06746 1/20 0.45
GAA P10253 1/20 0.44
ATM Q13315 1/20 0.44
MAPT P10636 2/20 0.43
NPC1 O15118 1/20 0.43
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.42
RXFP1 Q9HBX9 3/20 0.41
ALDH1A1 P00352 1/20 0.41
L3MBTL1 Q9Y468 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
SCHEMBL2183053 0.92 MEN1 (0.49) MEN1KMT2ALMNATP53RAB9A
SCHEMBL2183050 0.92 MEN1 (0.49) MEN1KMT2ALMNATP53RAB9A
SCHEMBL2181618 0.91 LMNA (0.51) MEN1KMT2ALMNATP53RAB9A
SCHEMBL2181176 0.88 MEN1 (0.48) MEN1KMT2ALMNATP53RAB9A
SCHEMBL2180791 0.86 LMNA (0.48) KMT2ALMNATP53RAB9AGAA
SCHEMBL2180669 0.85 LMNA (0.47) MEN1KMT2ALMNATP53RAB9A
SCHEMBL2181097 0.85 TP53 (0.45) MEN1KMT2ALMNATP53RAB9A
SCHEMBL13719150 0.84 LMNA (0.51) MEN1KMT2ALMNATP53RAB9A
SCHEMBL2178488 0.84 LMNA (0.51) MEN1KMT2ALMNATP53RAB9A
SCHEMBL2179906 0.84 LMNA (0.47) LMNATP53KCNK3KCNK9GAA

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 4 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 claimed
WO-2011080718-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE PIRAMAL LIFE SCIENCES LIMITED (IN) 2011-07-07 WO claimed
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