SCHEMBL8325685

SCHEMBL8325685

CCN(CC)CC#Cc1cccc(-c2c(NC(=O)Nc3c(C(C)C)cccc3C(C)C)c(=O)n(CCCc3ccccc3)c3ncccc23)c1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACAT1 P24752 1/20 0.53
SOAT1 P35610 1/20 0.52
TP53 P04637 1/20 0.34
MAPT P10636 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
SCHEMBL8324423 0.97 ACAT1 (0.50) ACAT1SOAT1TP53MAPT
SCHEMBL8323123 0.94 ACAT1 (0.60) ACAT1SOAT1
SCHEMBL8328195 0.94 ACAT1 (0.56) ACAT1SOAT1
SCHEMBL8328681 0.93 ACAT1 (0.60) ACAT1SOAT1
SCHEMBL8331699 0.92 ACAT1 (0.57) ACAT1SOAT1
SCHEMBL8330372 0.91 ACAT1 (0.59) ACAT1SOAT1
SCHEMBL8329115 0.91 ACAT1 (0.52) ACAT1SOAT1MAPT
SCHEMBL8328468 0.91 ACAT1 (0.56) ACAT1SOAT1TP53MAPT
SCHEMBL8324971 0.91 ACAT1 (0.52) ACAT1SOAT1MAPT
SCHEMBL8322732 0.91 ACAT1 (0.55) 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