SCHEMBL20004725

SCHEMBL20004725

COCc1ccc(C#Cc2cc3cc(C)cnc3[nH]2)s1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SNCA P37840 2/20 0.36
MAPT P10636 1/20 0.31
KIT P10721 1/20 0.31
ABL1 P00519 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
SCHEMBL20004463 0.88 SNCA (0.50) SNCAMAPTKIT
SCHEMBL20004449 0.72 SNCA (0.50) SNCAMAPTKIT
SCHEMBL20004473 0.72 SNCA (0.56) SNCAMAPTKIT
SCHEMBL22537701 0.71 SNCA (0.56) SNCAMAPTKITABL1
SCHEMBL22537721 0.70 SNCA (0.54) SNCAMAPT
SCHEMBL22537582 0.70 EGFR (0.31)
SCHEMBL22537820 0.69 SNCA (0.51) SNCAMAPTKIT
SCHEMBL20005168 0.68 SNCA (0.37) SNCAMAPTKIT
SCHEMBL22537895 0.67 SNCA (0.45) SNCAMAPT
SCHEMBL22537877 0.66 SNCA (0.75) 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 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