SCHEMBL20752196

SCHEMBL20752196

CNc1nc(Nc2ccc(F)c(-n3nnnc3C)c2)ncc1N(C)C

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 3/20 0.49
PRKCQ Q04759 9/20 0.42
AURKA O14965 3/20 0.37
SYK P43405 2/20 0.37
STK17A Q9UEE5 2/20 0.35
KCNN4 O15554 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
SCHEMBL20752142 0.89 LRRK2 (0.53) LRRK2PRKCQAURKASYK
SCHEMBL20752230 0.88 LRRK2 (0.52) LRRK2PRKCQAURKASYKSTK17A
SCHEMBL20752318 0.87 LRRK2 (0.51) LRRK2PRKCQSTK17A
SCHEMBL20752295 0.86 LRRK2 (0.51) LRRK2PRKCQSYKSTK17A
SCHEMBL20752159 0.84 LRRK2 (0.68) LRRK2STK17A
SCHEMBL20752245 0.84 LRRK2 (0.61) LRRK2PRKCQAURKASYKSTK17A
SCHEMBL20752297 0.84 LRRK2 (0.47) LRRK2PRKCQ
SCHEMBL20752189 0.83 LRRK2 (0.49) LRRK2PRKCQAURKASYK
SCHEMBL20752195 0.82 SYK (0.50) LRRK2PRKCQSYK
SCHEMBL15769166 0.80 PRKCQ (0.51) LRRK2PRKCQSYK

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
EP-2928891-B1 PROTEIN KINASE C INHIBITORS AND USES THEREOF RIGEL PHARMACEUTICALS INC (US) 2019-02-20 EP disclosed