SCHEMBL30693271

SCHEMBL30693271

NC(=O)c1cccnc1Oc1ccc(CC(=O)Nc2nc3ccccc3o2)cc1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 19/20 0.66
CSNK1D P48730 1/20 0.57

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
SCHEMBL23356713 1.00 ROCK2 (0.66) ROCK2CSNK1D
SCHEMBL29708212 1.00 ROCK2 (0.66) ROCK2CSNK1D
SCHEMBL26177489 0.87 CSNK1D (0.59) ROCK2CSNK1D
SCHEMBL30693313 0.79 ROCK2 (1.00) ROCK2
SCHEMBL29708450 0.79 ROCK2 (1.00) ROCK2
SCHEMBL23356641 0.79 ROCK2 (1.00) ROCK2
SCHEMBL9896282 0.77 CSNK1D (0.74) ROCK2CSNK1D
SCHEMBL23356671 0.75 ROCK2 (0.75) ROCK2
SCHEMBL30693309 0.75 ROCK2 (0.75) ROCK2
SCHEMBL29708443 0.75 ROCK2 (0.75) ROCK2

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
CN-110869360-B Phenylacetamides as ROCK inhibitors 百时美施贵宝公司 2023-12-15 CN claimed