SCHEMBL7124640

SCHEMBL7124640

O=C(O)NC(Cc1cccc(OC(F)(F)C(F)F)c1)C(O)c1cccc(F)n1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CETP P11597 17/20 0.39
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 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
SCHEMBL5755114 0.85 CETP (0.41) CETP
SCHEMBL5752782 0.84 CETP (0.36) CETP
SCHEMBL5752233 0.83 CETP (0.38) CETP
SCHEMBL7153377 0.83 CETP (0.38) CETP
SCHEMBL7123267 0.83 CETP (0.38) CETP
SCHEMBL5754635 0.82 CETP (0.41) CETP
SCHEMBL7159258 0.82 CETP (0.41) CETP
SCHEMBL1899264 0.82 CTSL (0.38) CETP
SCHEMBL5751825 0.82 ALDH1A1 (0.40) CETP
SCHEMBL5752406 0.81 CETP (0.43) 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-1362846-A1 AMINOETHANOL DERIVATIVES Takeda Chemical Industries, Ltd. (JP) 2003-11-19 EP disclosed