SCHEMBL2179906

SCHEMBL2179906

COC(=O)C(C(C)C)N1Cc2ccc(-c3ccc(NC(=O)c4ccccc4C(F)(F)F)cc3)cc2C1=O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
TP53 P04637 1/20 0.47
PTPRC P08575 1/20 0.45
PDE3B Q13370 1/20 0.42
PDE3A Q14432 1/20 0.42
THRB P10828 2/20 0.41
PTGES O14684 2/20 0.39
GAA P10253 1/20 0.39
ATM Q13315 1/20 0.39
APOB P04114 3/20 0.39
MTTP P55157 3/20 0.39
KCNK3 O14649 3/20 0.38
KCNK9 Q9NPC2 3/20 0.38
PTGS1 P23219 1/20 0.38
RECQL P46063 1/20 0.38
F2R P25116 1/20 0.38

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
SCHEMBL2179993 0.91 PTPRC (0.46) LMNATP53PTPRCPDE3BPDE3A
SCHEMBL2179986 0.91 PTPRC (0.46) LMNATP53PTPRCPDE3BPDE3A
SCHEMBL2179020 0.90 LMNA (0.42) LMNATP53THRB
SCHEMBL2178360 0.88 LMNA (0.43) LMNATP53THRBGAAATM
SCHEMBL2181618 0.87 LMNA (0.51) LMNATP53GAAATMKCNK3
SCHEMBL2180791 0.87 LMNA (0.48) LMNATP53GAAATM
SCHEMBL2180669 0.85 LMNA (0.47) LMNATP53GAAATM
SCHEMBL2177933 0.85 LMNA (0.41) LMNATP53THRB
SCHEMBL2179175 0.85 TRPV4 (0.46) LMNATP53THRBPTGESAPOB
SCHEMBL2180255 0.84 LMNA (0.51) LMNATP53THRBGAAATM

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