SCHEMBL15739490

SCHEMBL15739490

CCN(CC1CCC1)c1nc2ccccc2cc1CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C1=NN(C)NN1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 1/20 0.31
TACR1 P25103 1/20 0.31

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
SCHEMBL15739482 0.98 TACR1 (0.32) TACR1
SCHEMBL15981331 0.97 CRHR1 (0.32) CRHR1
SCHEMBL15739506 0.88 LMNA (0.33) CRHR1TACR1
SCHEMBL14389954 0.86
SCHEMBL15739594 0.84
SCHEMBL5624240 0.83 CETP (0.38)
SCHEMBL5624474 0.83 TACR1 (0.33) CRHR1TACR1
SCHEMBL15981910 0.83 CETP (0.31) TACR1
SCHEMBL19188509 0.82 DHFR (0.32) CRHR1TACR1
SCHEMBL4361019 0.81 CETP (0.38)

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
WO-2014128564-A2 PHARMACEUTICAL COMPOSITIONS OF CETP INHIBITORS DR. REDDY'S LABORATORIES LTD. (IN) 2014-08-28 WO disclosed
WO-2014076568-A2 PHARMACEUTICAL COMPOSITIONS OF CETP INHIBITORS DR. REDDY'S LABORATORIES LTD. (IN) 2014-05-22 WO disclosed