SCHEMBL8329683

SCHEMBL8329683

CC(C)c1cccc(C(C)C)c1NC(=O)Nc1c(-c2cccc(CCCO)c2)c2cccnc2n(CCCO)c1=O

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACAT1 P24752 1/20 0.66
SOAT1 P35610 1/20 0.64
CNR2 P34972 1/20 0.39
RXFP1 Q9HBX9 2/20 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
SCHEMBL8323082 0.96 ACAT1 (0.72) ACAT1SOAT1
SCHEMBL8327460 0.96 ACAT1 (0.63) ACAT1SOAT1
SCHEMBL8329300 0.94 ACAT1 (0.61) ACAT1SOAT1RXFP1
SCHEMBL8327009 0.94 ACAT1 (0.61) ACAT1SOAT1RXFP1
SCHEMBL8327483 0.93 ACAT1 (0.64) ACAT1SOAT1RXFP1
SCHEMBL8330813 0.93 ACAT1 (0.60) ACAT1SOAT1CNR2RXFP1
SCHEMBL8331742 0.91 ACAT1 (0.67) ACAT1SOAT1
SCHEMBL6640119 0.89 ACAT1 (0.73) ACAT1SOAT1
SCHEMBL6635284 0.87 ACAT1 (0.62) ACAT1SOAT1
SCHEMBL8326294 0.87 ACAT1 (0.62) ACAT1SOAT1CNR2RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0947515-A1 NOVEL NAPHTHYRIDINE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1999-10-06 EP disclosed