SCHEMBL8928608

SCHEMBL8928608

NCc1nnc2n1-c1sc(C3CC3)cc1C(c1ccccc1Cl)=NC2

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.53
PDE4D Q08499 1/20 0.53
PTAFR P25105 19/20 0.53

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
SCHEMBL11508821 0.87 OPRK1 (0.57) OPRK1PDE4DPTAFR
SCHEMBL8928550 0.85 OPRK1 (0.60) OPRK1PDE4DPTAFR
SCHEMBL8928388 0.84 PTAFR (0.73) OPRK1PDE4DPTAFR
SCHEMBL8928568 0.84 OPRK1 (0.76) OPRK1PDE4DPTAFR
SCHEMBL8928948 0.83 OPRK1 (0.55) OPRK1PDE4DPTAFR
SCHEMBL8929065 0.82 OPRK1 (0.64) OPRK1PDE4DPTAFR
SCHEMBL8928529 0.81 OPRK1 (0.47) OPRK1PDE4DPTAFR
SCHEMBL8928576 0.81 OPRK1 (0.57) OPRK1PDE4DPTAFR
SCHEMBL11868021 0.78 GABRA1 (0.48) OPRK1PDE4DPTAFR
SCHEMBL6994417 0.78 PTAFR (0.67) OPRK1PDE4DPTAFR

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
EP-0776892-A1 THIENYLAZOLE COMPOUND AND THIENOTRIAZOLODIAZEPINE COMPOUND YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-06-04 EP disclosed