SCHEMBL25826937

SCHEMBL25826937

CC(C)CCC1(C)OB(c2cc(F)c3c(c2)CC(=O)N3)OC1(C)C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ROCK1 Q13464 1/20 0.31

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
SCHEMBL20112979 0.89 ROCK1 (0.32) ROCK1
SCHEMBL15288616 0.84 LIPG (0.40) ROCK1
SCHEMBL20106736 0.77 GRIA1 (0.34)
SCHEMBL20112881 0.76 AHR (0.35)
SCHEMBL21493489 0.75 KIF11 (0.39) ROCK1
SCHEMBL20112974 0.74 CSF1R (0.30)
SCHEMBL20112906 0.71 LPL (0.31)
SCHEMBL18189371 0.70 LIPG (0.35) ROCK1
SCHEMBL18189401 0.70 GRIA1 (0.38)
SCHEMBL18189549 0.69 AHR (0.43) ROCK1

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-2023133375-A1 MACROCYCLIC COMPOUNDS AND USE AS KINASE INHIBITORS BLOSSOMHILL THERAPEUTICS, INC. (US) 2023-07-13 WO disclosed