SCHEMBL2178261

SCHEMBL2178261

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

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
GAA P10253 2/20 0.43
LMNA P02545 4/20 0.43
THRB P10828 1/20 0.43
TP53 P04637 1/20 0.43
ALDH1A1 P00352 1/20 0.40
KDR P35968 1/20 0.40
ATM Q13315 1/20 0.39
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
DGAT1 O75907 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
SDCBP O00560 2/20 0.36
SDC2 P34741 2/20 0.36

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
SCHEMBL2179912 0.92 LMNA (0.48) MAPTGAALMNATHRBTP53
SCHEMBL2179818 0.91 LMNA (0.44) MAPTMEN1KMT2AGAALMNA
SCHEMBL13719256 0.91 LMNA (0.44) MAPTMEN1KMT2AGAALMNA
SCHEMBL2179560 0.91 NPC1 (0.51) MEN1KMT2ALMNATHRBTP53
SCHEMBL2180394 0.86 HTR2A (0.40) MAPTMEN1KMT2AGAALMNA
SCHEMBL2178455 0.86 LMNA (0.40) MAPTMEN1KMT2AGAALMNA
SCHEMBL2224009 0.86 HTR2A (0.40) MAPTMEN1KMT2AGAALMNA
SCHEMBL2223220 0.85 LMNA (0.47) MAPTMEN1KMT2AGAALMNA
SCHEMBL2180501 0.85 LMNA (0.47) MAPTMEN1KMT2AGAALMNA
SCHEMBL2179349 0.84 CSGALNACT1 (0.43) MAPTLMNATHRBTP53KDR

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