SCHEMBL14698017

SCHEMBL14698017

CC1(C)CCc2cc(CN(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)c3ncc(CC=O)cn3)c(N(CC3CC3)CC3CC3)nc21

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CETP P11597 13/20 0.33

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
SCHEMBL14698042 0.90 CETP (0.34) CETP
SCHEMBL14698016 0.88 CETP (0.34) CETP
SCHEMBL14698063 0.88 CETP (0.34) CETP
SCHEMBL14698324 0.88 CETP (0.33) CETP
SCHEMBL14697716 0.87 CETP (0.32) CETP
SCHEMBL14698380 0.87 CETP (0.34) CETP
SCHEMBL14699576 0.86 ALDH1A1 (0.33) CETP
SCHEMBL14698379 0.86 ALDH1A1 (0.33) CETP
SCHEMBL17414303 0.85 CETP (0.31) CETP
SCHEMBL14697970 0.85 CETP (0.35) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2744803-A2 SUBSTITUTED HETEROCYCLIC AMINE COMPOUNDS AS CHOLESTRYL ESTER-TRANSFER PROTEIN (CETP) INHIBITORS Dr. Reddy's Laboratories Ltd. (IN) 2014-06-25 EP disclosed
WO-2013024358-A2 SUBSTITUTED HETEROCYCLIC AMINE COMPOUNDS AS CHOLESTRYL ESTER-TRANSFER PROTEIN (CETP) INHIBITORS DR. REDDY'S LABORATORIES LTD. (IN) 2013-02-21 WO disclosed