SCHEMBL3720701

SCHEMBL3720701

CCOn1c(NCCc2ccc(C(F)(F)F)cc2)nc2c(c1=O)CNCC2

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PRLHR P49683 16/20 0.42
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
EGLN1 Q9GZT9 1/20 0.38
MCHR1 Q99705 1/20 0.36
PDE2A O00408 1/20 0.35

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
SCHEMBL3713567 0.91 PRLHR (0.49) PRLHRHTR2CHTR2B
SCHEMBL3719992 0.90 PRLHR (0.43) PRLHRHTR2CHTR2BEGLN1
SCHEMBL3724228 0.85 PRLHR (0.48) PRLHRHTR2CHTR2B
SCHEMBL3714704 0.83 HTR2C (0.40) PRLHRHTR2CHTR2BEGLN1PDE2A
SCHEMBL433627 0.82 PRLHR (0.61) PRLHR
SCHEMBL3716376 0.80 PRLHR (0.44) PRLHR
SCHEMBL3723937 0.80 PRLHR (0.42) PRLHRHTR2CHTR2BEGLN1
SCHEMBL3716628 0.79 PRLHR (0.44) PRLHRHTR2CHTR2BEGLN1PDE2A
SCHEMBL3716509 0.78 PRLHR (0.51) PRLHRHTR2CHTR2B
SCHEMBL3723010 0.77 PRLHR (0.43) PRLHRHTR2C

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