SCHEMBL2662944

SCHEMBL2662944

Fc1cc(-c2ccccn2)ccc1-c1cc(-c2ccc(Cl)cc2)[nH]c1-c1ccncc1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GCGR P47871 14/20 0.60
MAPK14 Q16539 13/20 0.60

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
SCHEMBL2662867 0.81 GCGR (0.73) GCGRMAPK14
SCHEMBL2654728 0.76 MAPK14 (0.64) GCGRMAPK14
SCHEMBL2646773 0.75 GCGR (1.00) GCGRMAPK14
SCHEMBL2662940 0.75 GCGR (0.97) GCGRMAPK14
SCHEMBL2662945 0.72 GCGR (1.00) GCGRMAPK14
SCHEMBL2645507 0.71 GCGR (0.88) GCGRMAPK14
SCHEMBL4179971 0.69 CBFB (0.67)
SCHEMBL28714020 0.68 TOP1 (0.51) MAPK14
SCHEMBL160064 0.68 KDM4E (0.67)
SCHEMBL2662559 0.67 GCGR (1.00) GCGRMAPK14

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-1997016442-A1 SUBSTITUTED PYRIDYL PYRROLES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE MERCK & CO., INC. (US) 1997-05-09 WO disclosed