SCHEMBL20752168

SCHEMBL20752168

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

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 9/20 0.59
LRRK2 Q5S007 4/20 0.48
BRD4 O60885 3/20 0.43
JAK2 O60674 2/20 0.43
JAK1 P23458 2/20 0.43
JAK3 P52333 2/20 0.43
EIF2AK4 Q9P2K8 1/20 0.40
IGF1R P08069 1/20 0.40

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
SCHEMBL20752081 0.91 PRKCQ (0.59) PRKCQLRRK2BRD4IGF1R
SCHEMBL20752134 0.90 PRKCQ (0.58) PRKCQLRRK2BRD4JAK2
SCHEMBL20752186 0.88 PRKCQ (0.56) PRKCQLRRK2BRD4JAK2JAK1
SCHEMBL20752181 0.87 LRRK2 (0.62) PRKCQLRRK2
SCHEMBL20752144 0.87 PRKCQ (0.55) PRKCQLRRK2
SCHEMBL20752079 0.82 PRKCQ (0.51) PRKCQIGF1R
SCHEMBL3495246 0.82 PRKCQ (0.85) PRKCQLRRK2BRD4JAK2JAK1
SCHEMBL20752307 0.82 JAK2 (0.55) BRD4JAK2JAK1JAK3IGF1R
SCHEMBL20752218 0.80 LRRK2 (0.56) PRKCQLRRK2BRD4JAK2JAK1
SCHEMBL1871031 0.79 PRKCQ (0.53) PRKCQLRRK2BRD4JAK2JAK3

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