SCHEMBL20865124

SCHEMBL20865124

C[C@]12OC(C[C@@H]1C(=O)O)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)CNC4=O

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 16/20 0.84
ROCK2 O75116 10/20 0.84
PRKCA P17252 8/20 0.73
MAP3K5 Q99683 3/20 0.73
PRKD3 O94806 8/20 0.73
PRKCG P05129 8/20 0.73
PRKCZ Q05513 8/20 0.73
PRKCB P05771 7/20 0.73
PRKCH P24723 7/20 0.73
PRKCI P41743 7/20 0.73
PRKCE Q02156 7/20 0.73
PRKCD Q05655 7/20 0.73
PRKD1 Q15139 7/20 0.73
EGFR P00533 6/20 0.69
PRKACA P17612 6/20 0.69
PRKACG P22612 5/20 0.69
PRKACB P22694 5/20 0.69
CHEK1 O14757 3/20 0.69
MAPK1 P28482 3/20 0.69
KDR P35968 3/20 0.69

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
SCHEMBL22765174 0.91 PRKCQ (1.00) PRKCQROCK2PRKCAMAP3K5PRKD3
SCHEMBL26076886 0.89 PRKCQ (0.85) PRKCQROCK2PRKCAMAP3K5PRKD3
SCHEMBL12570343 0.88 PRKCQ (1.00) PRKCQROCK2PRKCAMAP3K5PRKD3
SCHEMBL20841734 0.88 PRKCQ (1.00) PRKCQROCK2PRKCAMAP3K5PRKD3
SCHEMBL22765238 0.88 PRKCQ (1.00) PRKCQROCK2PRKCAMAP3K5PRKD3
SCHEMBL12570346 0.88 PRKCQ (1.00) PRKCQROCK2PRKCAMAP3K5PRKD3
SCHEMBL20865123 0.88 PRKCQ (0.80) PRKCQROCK2PRKCAMAP3K5PRKD3
SCHEMBL12963562 0.88 PRKCQ (0.79) PRKCQROCK2PRKCAMAP3K5PRKD3
SCHEMBL638600 0.85 PRKCQ (0.83) PRKCQROCK2PRKCAMAP3K5PRKD3
SCHEMBL22765429 0.85 PRKCQ (0.83) PRKCQROCK2PRKCAMAP3K5PRKD3

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-2019067396-A1 ZAP-70 KINASE INHIBITOR COMPOSITIONS, METHODS AND USES THEREOF SNAP BIO, INC. (US) 2019-04-04 WO disclosed