SCHEMBL20005163

SCHEMBL20005163

CN(CCF)c1cccc(C#Cc2cc3c([nH]2)=NCCC=3)c1

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
SNCA P37840 2/20 0.44
APP P05067 1/20 0.31

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
SCHEMBL22537754 0.85 SNCA (0.52) MAPTSNCAAPP
SCHEMBL22537542 0.79 SNCA (0.39) MAPTSNCA
SCHEMBL21147086 0.79 GRM5 (0.41) MAPTSNCA
SCHEMBL20005013 0.79 GRM5 (0.40)
SCHEMBL21147289 0.76 PIK3CA (0.38)
SCHEMBL21147267 0.75 SNCA (0.51) MAPTSNCAAPP
SCHEMBL20004711 0.73 SNCA (0.80) MAPTSNCAAPP
SCHEMBL22537729 0.73
SCHEMBL20004515 0.73 APP (0.38) MAPTSNCAAPP
SCHEMBL20004527 0.73 SNCA (0.37) MAPTSNCA

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-2018055316-A1 COMPOUNDS FOR USING IN IMAGING AND PARTICULARLY FOR THE DIAGNOSIS OF NEURODEGENERATIVE DISEASES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2018-03-29 WO disclosed