SCHEMBL8328666

SCHEMBL8328666

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

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACAT1 P24752 1/20 0.57
SOAT1 P35610 2/20 0.56
KDM4E B2RXH2 1/20 0.34
NSD2 O96028 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL6638904 0.94 ACAT1 (0.62) ACAT1SOAT1
SCHEMBL8323473 0.90 ACAT1 (0.54) ACAT1SOAT1KDM4ENSD2ALDH1A1
SCHEMBL8330240 0.90 ACAT1 (0.53) ACAT1SOAT1
SCHEMBL8328479 0.89 ACAT1 (0.69) ACAT1SOAT1
SCHEMBL8326346 0.89 ACAT1 (0.69) ACAT1SOAT1KDM4ENSD2ALDH1A1
SCHEMBL8329227 0.89 ACAT1 (0.57) ACAT1SOAT1KDM4ENSD2ALDH1A1
SCHEMBL8324948 0.88 ACAT1 (0.52) ACAT1SOAT1
SCHEMBL8326851 0.85 ACAT1 (0.62) ACAT1SOAT1
SCHEMBL8325491 0.85 ACAT1 (0.64) ACAT1SOAT1
SCHEMBL8322732 0.84 ACAT1 (0.55) ACAT1SOAT1KDM4ENSD2ALDH1A1

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