SCHEMBL12423562

SCHEMBL12423562

CC(C)c1nc2c(c3c1[C@@H](c1ccc(C(F)(F)F)cn1)OC31CCOCC1)C(O)CC(C)(C)[C@H]2O

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CETP P11597 20/20 0.68

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
SCHEMBL12423815 1.00 CETP (0.68) CETP
SCHEMBL662383 1.00 CETP (0.68) CETP
SCHEMBL16258469 1.00 CETP (0.68) CETP
SCHEMBL662436 1.00 CETP (0.68) CETP
SCHEMBL16258429 0.91 CETP (0.75) CETP
SCHEMBL663740 0.91 CETP (0.75) CETP
SCHEMBL12423406 0.91 CETP (0.75) CETP
SCHEMBL12423404 0.89 CETP (0.84) CETP
SCHEMBL661248 0.89 CETP (0.84) CETP
SCHEMBL16258340 0.85 CETP (0.88) 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-2536733-B1 TRICYCLIC PYRIDINE DERIVATIVES, MEDICAMENTS CONTAINING SUCH COMPOUNDS, THEIR USE AND PROCESS FOR THEIR PREPARATION BOEHRINGER INGELHEIM INT (DE) 2014-11-26 EP disclosed
WO-2011101424-A1 TRICYCLIC PYRIDINE DERIVATIVES, MEDICAMENTS CONTAINING SUCH COMPOUNDS, THEIR USE AND PROCESS FOR THEIR PREPARATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-08-25 WO disclosed