SCHEMBL2179912

SCHEMBL2179912

COC(=O)C(C(C)C)N1Cc2ccc(-c3ccc(NC(=O)Nc4ccc(C)c(C)c4)c(F)c3)cc2C1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
THRB P10828 1/20 0.48
TP53 P04637 1/20 0.44
MAPT P10636 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
KDR P35968 2/20 0.41
TSHR P16473 1/20 0.41
RECQL P46063 1/20 0.41
ROCK2 O75116 1/20 0.39
MAP4K4 O95819 1/20 0.39
LCK P06239 1/20 0.39
RET P07949 1/20 0.39
PIM1 P11309 1/20 0.39
RPS6KB1 P23443 1/20 0.39
GSK3B P49841 1/20 0.39
BLK P51451 1/20 0.39
PRKCD Q05655 1/20 0.39
PRKAA1 Q13131 1/20 0.39
STK3 Q13188 1/20 0.39
ROCK1 Q13464 1/20 0.39

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
SCHEMBL2178995 0.92 LMNA (0.49) LMNATHRBTP53MAPTTDP1
SCHEMBL2179002 0.92 LMNA (0.49) LMNATHRBTP53MAPTTDP1
SCHEMBL2178261 0.92 MAPT (0.43) LMNATHRBTP53MAPTKDR
SCHEMBL2179560 0.89 NPC1 (0.51) LMNATHRBTP53KDRPOLB
SCHEMBL2179704 0.84 LMNA (0.41) LMNATHRBTP53MAPTTDP1
SCHEMBL2180501 0.84 LMNA (0.47) LMNATHRBTP53MAPTSDCBP
SCHEMBL2223220 0.84 LMNA (0.47) LMNATHRBTP53MAPTSDCBP
SCHEMBL13719256 0.83 LMNA (0.44) LMNATHRBTP53MAPTKDR
SCHEMBL2179818 0.83 LMNA (0.44) LMNATHRBTP53MAPTKDR
SCHEMBL2176524 0.82 LMNA (0.46) LMNATHRBTP53KDRROCK2

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