SCHEMBL20752188

SCHEMBL20752188

CNc1nc(Nc2ccc(F)c(-n3nnnc3C3CC3)c2)ncc1C#N

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 15/20 0.41
SYK P43405 1/20 0.39
AURKA O14965 1/20 0.39
PRKCQ Q04759 1/20 0.38
GRM5 P41594 1/20 0.38
MAPK6 Q16659 1/20 0.38

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
SCHEMBL20752086 0.90 LRRK2 (0.39) LRRK2SYKAURKAPRKCQ
SCHEMBL20752189 0.86 LRRK2 (0.49) LRRK2SYKAURKAPRKCQ
SCHEMBL20752088 0.84 LRRK2 (0.44) LRRK2
SCHEMBL15769534 0.82 PRKCQ (0.41) LRRK2AURKAPRKCQ
SCHEMBL15769535 0.79 PRKCQ (0.34) PRKCQGRM5MAPK6
SCHEMBL20752184 0.75 SYK (0.55) LRRK2SYKAURKAPRKCQ
SCHEMBL1740757 0.74 PRKCQ (0.50) LRRK2SYKAURKAPRKCQGRM5
SCHEMBL20752142 0.74 LRRK2 (0.53) LRRK2SYKAURKAPRKCQ
SCHEMBL20752241 0.74 LRRK2 (0.50) LRRK2
SCHEMBL20752250 0.73 LRRK2 (0.47) LRRK2PRKCQ

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