SCHEMBL8324735

SCHEMBL8324735

CCCCn1c(=O)c(NC(=O)Nc2c(C(C)C)cccc2C(C)C)c(-c2cccc(OCc3ccccc3)c2)c2cccnc21

nearest known ligand 0.82

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACAT1 P24752 1/20 0.72
SOAT1 P35610 1/20 0.71
PDE4A P27815 1/20 0.39
KCNH2 Q12809 1/20 0.39
MAPT P10636 1/20 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
SCHEMBL6636784 0.95 ACAT1 (0.72) ACAT1SOAT1PDE4AKCNH2
SCHEMBL6635287 0.94 ACAT1 (0.72) ACAT1SOAT1PDE4AKCNH2MAPT
SCHEMBL29427709 0.94 ACAT1 (0.70) ACAT1SOAT1
SCHEMBL5990213 0.94 ACAT1 (0.70) ACAT1SOAT1
SCHEMBL8330841 0.93 ACAT1 (0.69) ACAT1SOAT1PDE4AKCNH2
SCHEMBL8330165 0.92 ACAT1 (0.68) ACAT1SOAT1PDE4AKCNH2
SCHEMBL8327196 0.92 ACAT1 (0.68) ACAT1SOAT1PDE4AKCNH2
SCHEMBL8327488 0.92 ACAT1 (0.68) ACAT1SOAT1PDE4AKCNH2
SCHEMBL6637175 0.92 ACAT1 (0.72) ACAT1SOAT1PDE4AKCNH2
SCHEMBL8327206 0.91 ACAT1 (0.81) ACAT1SOAT1PDE4AKCNH2

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 3 patents. 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
EP-0901489-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE Merck & Co., Inc. (US) 1999-03-17 EP disclosed
WO-1997044339-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO., INC. (US) 1997-11-27 WO disclosed