SCHEMBL6938810

SCHEMBL6938810

CCCc1[c]c(CCC)cc(C(=O)C(NS(=O)(=O)O)c2c(C(C)C)cc(C(C)C)cc2C(C)C)c1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 2/20 0.37
FABP4 P15090 2/20 0.37
FABP5 Q01469 1/20 0.37
GAA P10253 1/20 0.32
SOAT2 O75908 1/20 0.31
MYC P01106 1/20 0.31
SOAT1 P35610 1/20 0.31
MAP2K3 P46734 1/20 0.31

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
SCHEMBL5469738 0.83 FABP3 (0.40) FABP3FABP4FABP5GAASOAT2
SCHEMBL5704723 0.79 PPARG (0.33)
SCHEMBL5704698 0.79
SCHEMBL6940243 0.74 FABP3 (0.39) FABP3FABP4FABP5GAASOAT2
SCHEMBL5471203 0.71 NLRP3 (0.34)
SCHEMBL8706010 0.65 FABP3 (0.38) FABP3FABP4FABP5GAASOAT2
SCHEMBL7104863 0.62 FABP3 (0.40) FABP3FABP4FABP5GAA
SCHEMBL7108814 0.60 FABP3 (0.41) FABP3FABP4FABP5GAA
SCHEMBL8720137 0.59 FABP4 (0.58) FABP3FABP4FABP5GAASOAT2
SCHEMBL6936626 0.59 KAT6A (0.33) GAA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2003513909-A 2003-04-15 JP claimed
EP-1229907-A1 PREVENTION OF PLAQUE RUPTURE BY ACAT INHIBITORS WARNER-LAMBERT COMPANY (US) 2002-08-14 EP claimed
WO-2001034127-A1 PREVENTION OF PLAQUE RUPTURE BY ACAT INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-05-17 WO claimed