SCHEMBL20752144

SCHEMBL20752144

CNc1nc(Nc2cc(OC)cc(-n3nnnc3C)c2)ncc1C#N

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 8/20 0.55
LRRK2 Q5S007 9/20 0.44
CDK1 P06493 1/20 0.43
KDR P35968 1/20 0.43
PLK1 P53350 1/20 0.41

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
SCHEMBL20752168 0.87 PRKCQ (0.59) PRKCQLRRK2
SCHEMBL20752081 0.86 PRKCQ (0.59) PRKCQLRRK2
SCHEMBL20752134 0.85 PRKCQ (0.58) PRKCQLRRK2
SCHEMBL20752186 0.84 PRKCQ (0.56) PRKCQLRRK2
SCHEMBL3493786 0.83 PRKCQ (0.79) PRKCQLRRK2CDK1KDRPLK1
SCHEMBL3496289 0.83 PRKCQ (0.65) PRKCQLRRK2CDK1KDRPLK1
SCHEMBL20752181 0.83 LRRK2 (0.62) PRKCQLRRK2
SCHEMBL20752300 0.82 SRC (0.56) LRRK2CDK1KDRPLK1
SCHEMBL20752241 0.82 LRRK2 (0.50) LRRK2
SCHEMBL15769567 0.80 PRKCQ (0.60) PRKCQLRRK2PLK1

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