SCHEMBL12844259

SCHEMBL12844259

COc1cc(-c2cc(C(C)C)ccc2OC)c(CN(Cc2cc(C#N)cc(C(F)(F)F)c2)c2ncc(OCCCC(=O)O)cn2)cc1C

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CETP P11597 20/20 0.60

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
SCHEMBL12844047 0.98 CETP (0.61) CETP
SCHEMBL12062545 0.94 CETP (0.62) CETP
SCHEMBL12062544 0.93 CETP (0.62) CETP
SCHEMBL12062537 0.93 CETP (0.62) CETP
SCHEMBL12844043 0.92 CETP (0.67) CETP
SCHEMBL12062704 0.91 CETP (0.58) CETP
SCHEMBL12062702 0.91 CETP (0.63) CETP
SCHEMBL12062523 0.90 CETP (0.70) CETP
SCHEMBL12062665 0.89 CETP (0.63) CETP
SCHEMBL129382 0.89 CETP (0.69) 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
US-7906517-B2 Trisubstituted amine compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-03-15 US disclosed