SCHEMBL20005168

SCHEMBL20005168

Cc1cnc2[nH]c(C#Cc3ccc(CO)o3)cc2c1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SNCA P37840 3/20 0.37
KIT P10721 1/20 0.34
MAPT P10636 2/20 0.32
EGFR P00533 1/20 0.31
ERBB2 P04626 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
SCHEMBL21115292 0.86 SNCA (0.50) SNCAKITMAPTEGFRERBB2
SCHEMBL22537848 0.74 SNCA (0.41) SNCAMAPT
SCHEMBL20005069 0.74 SNCA (0.50) SNCAKITMAPT
SCHEMBL22537701 0.72 SNCA (0.56) SNCAKITMAPT
SCHEMBL22537781 0.72 SNCA (0.54) SNCAMAPT
SCHEMBL22537820 0.70 SNCA (0.51) SNCAKITMAPT
SCHEMBL22537877 0.68 SNCA (0.75) SNCAMAPT
SCHEMBL20004725 0.68 SNCA (0.36) SNCAKITMAPT
SCHEMBL13204734 0.67 ABL1 (0.45)
SCHEMBL20005091 0.65 SNCA (0.58) SNCAKITMAPTEGFR

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