SCHEMBL8322732

SCHEMBL8322732

C=CCCCn1c(=O)c(NC(=O)Nc2c(C(C)C)cccc2C(C)C)c(-c2cccc(C#CCN(CC)CC)c2)c2cccnc21

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACAT1 P24752 1/20 0.55
SOAT1 P35610 1/20 0.54
KDM4E B2RXH2 1/20 0.32
NSD2 O96028 1/20 0.32
ALDH1A1 P00352 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32

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
SCHEMBL8323123 0.94 ACAT1 (0.60) ACAT1SOAT1
SCHEMBL8328681 0.92 ACAT1 (0.60) ACAT1SOAT1KDM4ENSD2ALDH1A1
SCHEMBL8330372 0.91 ACAT1 (0.59) ACAT1SOAT1
SCHEMBL8328822 0.91 ACAT1 (0.58) ACAT1SOAT1RXFP1
SCHEMBL8325685 0.91 ACAT1 (0.53) ACAT1SOAT1
SCHEMBL8329115 0.90 ACAT1 (0.52) ACAT1SOAT1RXFP1
SCHEMBL8328523 0.90 ACAT1 (0.60) ACAT1SOAT1
SCHEMBL8324971 0.90 ACAT1 (0.52) ACAT1SOAT1KDM4ENSD2ALDH1A1
SCHEMBL8326559 0.89 ACAT1 (0.56) ACAT1SOAT1RXFP1
SCHEMBL8325704 0.89 ACAT1 (0.60) ACAT1SOAT1

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