SCHEMBL15519982

SCHEMBL15519982

CCN(CC1CCC(OC(C)=O)CC1)c1nc2ccccc2cc1CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1nnn(C)n1

nearest known ligand 0.42

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CETP P11597 20/20 0.42

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
SCHEMBL5626466 0.92 CETP (0.38) CETP
SCHEMBL4360534 0.90 CETP (0.43) CETP
SCHEMBL680303 0.90 CETP (0.39) CETP
SCHEMBL680302 0.90 CETP (0.39) CETP
SCHEMBL4361019 0.89 CETP (0.38) CETP
SCHEMBL5624240 0.89 CETP (0.38) CETP
SCHEMBL16743485 0.88 CETP (0.38) CETP
SCHEMBL16743085 0.87 CETP (0.37) CETP
Hydrochloric Acid SCHEMBL2568894 0.85 CETP (0.45) CETP
SCHEMBL16743081 0.85 CETP (0.36) CETP

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-2383253-B1 METHOD FOR MANUFACTURING TRANS-{4-[(ALKYL AMINO) METHYL]CYCLOHEXYL} ACETIC ESTER KOWA CO (JP) 2014-03-19 EP disclosed