SCHEMBL3716896

SCHEMBL3716896

COn1c(NCCCc2ccc(C(F)(F)F)cc2)nc2c(c1=O)CN(C(=O)c1ccc(C#N)cc1F)CC2

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PRLHR P49683 20/20 0.73

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
Hydrochloric Acid SCHEMBL3717032 0.95 PRLHR (0.75) PRLHR
Hydrochloric Acid SCHEMBL3717998 0.89 PRLHR (0.75) PRLHR
SCHEMBL3716894 0.85 PRLHR (0.73) PRLHR
SCHEMBL10285865 0.84 PRLHR (1.00) PRLHR
SCHEMBL437425 0.84 PRLHR (1.00) PRLHR
SCHEMBL3712999 0.84 PRLHR (0.75) PRLHR
SCHEMBL437481 0.84 PRLHR (1.00) PRLHR
SCHEMBL447581 0.84 PRLHR (1.00) PRLHR
Hydrochloric Acid SCHEMBL452585 0.84 PRLHR (1.00) PRLHR
SCHEMBL435948 0.82 PRLHR (1.00) PRLHR

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
WO-2010137738-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF STRESS-RELATED CONDITIONS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-12-02 WO disclosed