SCHEMBL5557141

SCHEMBL5557141

Clc1cc2c(s1)CCNNC2

nearest known ligand 0.42

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PNMT P11086 6/20 0.42

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
SCHEMBL3084897 0.82 PNMT (0.61) PNMT
SCHEMBL3586535 0.76 PNMT (0.49) PNMT
SCHEMBL13984175 0.69
SCHEMBL31564654 0.63 ALDH1A1 (0.39)
SCHEMBL16869981 0.60 PARP1 (0.43)
SCHEMBL9414836 0.60 DRD2 (0.43)
SCHEMBL31564089 0.60 DRD2 (0.43)
SCHEMBL930203 0.60 KCNQ2 (0.31) PNMT
SCHEMBL31563899 0.60 DRD2 (0.43)
SCHEMBL21236155 0.60 PNMT (0.63) PNMT

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
EP-1778243-A2 SUBSTITUTED AZEPINE DERIVATIVES AS SEROTONIN RECEPTOR MODULATORS Athersys, Inc. (US) 2007-05-02 EP disclosed
WO-2006004931-A2 SUBSTITUTED AZEPINE DERIVATIVES AS SEROTONIN RECEPTOR MODULATORS ATHERSYS, INC. (US) 2006-01-12 WO disclosed