SCHEMBL3720693

SCHEMBL3720693

COn1c(NCCc2ccc(C(F)(F)F)cc2)nc2c(c1=O)CN(C(=O)c1ccc(C)s1)CC2

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PRLHR P49683 20/20 0.72

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
SCHEMBL3716557 0.87 PRLHR (0.74) PRLHR
SCHEMBL3713146 0.85 PRLHR (0.72) PRLHR
SCHEMBL3714372 0.85 PRLHR (0.75) PRLHR
SCHEMBL3716959 0.84 PRLHR (0.75) PRLHR
SCHEMBL448265 0.84 PRLHR (1.00) PRLHR
Hydrochloric Acid SCHEMBL3720710 0.84 PRLHR (0.85) PRLHR
SCHEMBL437393 0.84 PRLHR (1.00) PRLHR
SCHEMBL3723098 0.83 PRLHR (0.70) PRLHR
SCHEMBL3716894 0.83 PRLHR (0.73) PRLHR
SCHEMBL3716887 0.82 PRLHR (0.73) 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