SCHEMBL3715419

SCHEMBL3715419

COn1c(N(CC(C)C)c2ccc(Cl)cc2)nc2c(c1=O)CNCC2

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PRLHR P49683 13/20 0.36
HTR2C P28335 4/20 0.34
HTR2B P41595 4/20 0.34
HTR2A P28223 3/20 0.34
SIGMAR1 Q99720 1/20 0.34
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32

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
SCHEMBL3716507 0.89 PRLHR (0.36) PRLHRHTR2CHTR2BHTR2ASIGMAR1
SCHEMBL3713570 0.87 PRLHR (0.35) PRLHRHTR2CHTR2BHTR2ATNKS
SCHEMBL3716369 0.83 PRLHR (0.39) PRLHRHTR2CHTR2B
SCHEMBL3715407 0.80 PRLHR (0.35) PRLHRHTR2CHTR2BHTR2ATNKS
SCHEMBL3717594 0.77 HTR2C (0.37) PRLHRHTR2CHTR2B
SCHEMBL3716574 0.76 PRLHR (0.47) PRLHR
SCHEMBL3724225 0.75 HTR2C (0.36) PRLHRHTR2CHTR2B
SCHEMBL436071 0.74 PRLHR (0.62) PRLHR
SCHEMBL3801713 0.73 PRLHR (0.46) PRLHR
SCHEMBL3721666 0.73 PRLHR (0.49) 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