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SCHEMBL6637153

SCHEMBL6637153

CC(C)c1cccc(C(C)C)c1NC(=O)Nc1c(-c2cccc(OCCO)c2)c2cccnc2n(CCCC#N)c1=O

nearest known ligand 0.73

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SOAT1 P35610 1/20 0.73
▸ ACAT1 P24752 1/20 0.72
▸ PDE4A P27815 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.35
▸ 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
SCHEMBL6637903 0.98 SOAT1 (0.76) SOAT1ACAT1PDE4AKCNH2RXFP1
SCHEMBL6635350 0.95 SOAT1 (0.68) SOAT1ACAT1PDE4AKCNH2
SCHEMBL6635347 0.93 SOAT1 (0.66) SOAT1ACAT1PDE4AKCNH2RXFP1
SCHEMBL6641577 0.93 SOAT1 (0.64) SOAT1ACAT1
SCHEMBL6639853 0.92 ACAT1 (0.85) SOAT1ACAT1PDE4AKCNH2
SCHEMBL6635246 0.92 SOAT1 (0.66) SOAT1ACAT1PDE4AKCNH2
SCHEMBL6641829 0.90 SOAT1 (0.63) SOAT1ACAT1
SCHEMBL6637874 0.90 SOAT1 (0.62) SOAT1ACAT1PDE4AKCNH2RXFP1
SCHEMBL6635258 0.90 ACAT1 (0.89) SOAT1ACAT1PDE4AKCNH2
SCHEMBL6633500 0.89 SOAT1 (0.59) SOAT1ACAT1RXFP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0842933-B1 NOVEL NAPHTHYRIDINE DERIVATIVES SUMITOMO PHARMA (JP) 2004-08-04 — — EP disclosed
EP-0842933-A1 NOVEL NAPHTHYRIDINE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-05-20 — — EP disclosed