SCHEMBL20004674

SCHEMBL20004674

CN(CCF)C1=CC(C#Cc2cc3cccnc3[nH]2)=CCC1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SNCA P37840 6/20 0.60
MAPT P10636 3/20 0.60
DRD2 P14416 1/20 0.31
DRD4 P21917 1/20 0.31
DRD3 P35462 1/20 0.31
APP P05067 1/20 0.30
DAO P14920 1/20 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
SCHEMBL20004668 0.77 SNCA (0.47) SNCAMAPT
SCHEMBL20004553 0.76 SNCA (1.00) SNCAMAPTAPPDAO
SCHEMBL20004711 0.74 SNCA (0.80) SNCAMAPTAPP
SCHEMBL20004597 0.73 SNCA (0.94) SNCAMAPTAPP
SCHEMBL20004397 0.72 SNCA (0.73) SNCAMAPTAPPDAO
SCHEMBL20005045 0.72 SNCA (0.72) SNCAMAPT
SCHEMBL20005061 0.70 SNCA (0.55) SNCAMAPTDRD2DRD4DRD3
SCHEMBL20004470 0.68 SNCA (0.81) SNCAMAPTDAO
SCHEMBL20005054 0.67 SNCA (0.69) SNCAMAPT
SCHEMBL22537694 0.67 SNCA (0.55) SNCAMAPTDRD2DRD4DRD3

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