SCHEMBL30611433

SCHEMBL30611433

CC1CN(c2ncc(F)c(Nc3ccc4[nH]ncc4c3)n2)CCN1

nearest known ligand 0.89

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 19/20 0.89
▸ ROCK1 Q13464 8/20 0.80

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
SCHEMBL20774589 1.00 ROCK2 (0.89) ROCK2ROCK1
SCHEMBL30611441 0.94 ROCK2 (1.00) ROCK2ROCK1
SCHEMBL20774595 0.94 ROCK2 (1.00) ROCK2ROCK1
SCHEMBL20774749 0.91 ROCK2 (0.77) ROCK2ROCK1
SCHEMBL30611396 0.91 ROCK2 (0.77) ROCK2ROCK1
SCHEMBL20774690 0.89 ROCK2 (0.89) ROCK2ROCK1
SCHEMBL30611365 0.89 ROCK2 (0.89) ROCK2ROCK1
SCHEMBL20774579 0.89 ROCK2 (0.80) ROCK2ROCK1
SCHEMBL20783981 0.89 ROCK2 (0.72) ROCK2ROCK1
SCHEMBL20774612 0.89 ROCK2 (0.72) ROCK2ROCK1

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-111587112-B Rho-related inhibitors of coiled-coil-containing protein kinases 卡德门企业有限公司 2023-10-10 — — CN disclosed
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