SCHEMBL20004447

SCHEMBL20004447

Fc1cnc2[nH]c(C#Cc3ccccc3)cc2c1

nearest known ligand 0.70

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SNCA P37840 9/20 0.70
MAPT P10636 5/20 0.46
GRM5 P41594 4/20 0.37
GRM4 Q14833 1/20 0.36
CDK2 P24941 1/20 0.36
APP P05067 1/20 0.35

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
SCHEMBL22537769 0.83 SNCA (0.71) SNCAMAPTAPP
SCHEMBL20004518 0.82 SNCA (1.00) SNCAMAPTAPP
SCHEMBL20005053 0.82 SNCA (0.76) SNCAMAPTGRM5
SCHEMBL21192533 0.80 SNCA (0.53) SNCAMAPT
SCHEMBL21115232 0.79 SNCA (0.93) SNCAMAPTAPP
SCHEMBL20005086 0.79 SNCA (0.58) SNCAMAPTGRM5
SCHEMBL21147622 0.79 SNCA (0.53) SNCAMAPT
SCHEMBL20005047 0.79 SNCA (0.53) SNCAMAPT
SCHEMBL20005049 0.78 SNCA (0.63) SNCAMAPT
SCHEMBL21170669 0.78 GRM5 (0.47) SNCAMAPTGRM5GRM4CDK2

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