SCHEMBL20005039

SCHEMBL20005039

CN(C)c1ccc(C#Cc2cc3c([nH]2)=NC(Cl)CC=3)cc1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SNCA P37840 12/20 0.46
MAPT P10636 7/20 0.46
ADK P55263 6/20 0.32
APP P05067 2/20 0.30

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
SCHEMBL21147267 0.78 SNCA (0.51) SNCAMAPTADKAPP
SCHEMBL20005040 0.76 SNCA (0.41) SNCAMAPT
SCHEMBL20004510 0.72 SNCA (0.47) SNCAMAPTADKAPP
SCHEMBL20005042 0.71 SNCA (0.46) SNCAMAPTADKAPP
SCHEMBL20005181 0.68 SNCA (0.46) SNCAMAPT
SCHEMBL22537750 0.68 SNCA (0.48) SNCAMAPTADKAPP
SCHEMBL22537688 0.68 SNCA (0.48) SNCAMAPTADKAPP
SCHEMBL20004394 0.68 SNCA (0.42) SNCAMAPTADKAPP
SCHEMBL20005002 0.66 SNCA (0.51) SNCAMAPTADKAPP
SCHEMBL20005146 0.64 SNCA (0.36) SNCAMAPT

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-3515912-B1 COMPOUNDS FOR USING IN IMAGING AND PARTICULARLY FOR THE DIAGNOSIS OF NEURODEGENERATIVE DISEASES CENTRE NAT RECH SCIENT (FR) 2020-10-14 EP disclosed
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