SCHEMBL6943095

SCHEMBL6943095

CCCCCCCCCCCCc1nnn(-c2c(C(C)C)cccc2C(C)C)n1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 1/20 0.37
KCNH2 Q12809 1/20 0.37
CYP19A1 P11511 3/20 0.36

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
SCHEMBL4409336 0.76 HPGD (0.49) KCNH2CYP19A1
SCHEMBL4414660 0.74 HPGD (0.50) CYP19A1
SCHEMBL7622071 0.72 MEN1 (0.47)
SCHEMBL6940091 0.72 MEN1 (0.47)
SCHEMBL6943100 0.71
SCHEMBL4412019 0.69 HPGD (0.51) CYP19A1
SCHEMBL9381324 0.69 KMT2A (0.47)
SCHEMBL4403680 0.68 CYP19A1 (0.34) CYP19A1
SCHEMBL4407677 0.67 FAAH (0.43) KCNH2CYP19A1
SCHEMBL4409333 0.66 MIF (0.33) CYP19A1

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
JP-2003513909-A 2003-04-15 JP claimed
EP-1229907-A1 PREVENTION OF PLAQUE RUPTURE BY ACAT INHIBITORS WARNER-LAMBERT COMPANY (US) 2002-08-14 EP claimed
WO-2001034127-A1 PREVENTION OF PLAQUE RUPTURE BY ACAT INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-05-17 WO claimed