SCHEMBL24862350

SCHEMBL24862350

CCc1cc(OCC(=O)NC2CC2)cc(-c2ncc(C)c(Nc3ccc4[nH]ncc4c3)n2)c1

nearest known ligand 0.79

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 18/20 0.79
▸ ROCK1 Q13464 12/20 0.79
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ SLC2A1 P11166 1/20 0.46
▸ SLC2A3 P11169 1/20 0.46
▸ CLK2 P49760 1/20 0.46
▸ BLK P51451 1/20 0.46
▸ CSNK2A1 P68400 1/20 0.46
▸ STK3 Q13188 1/20 0.46
▸ DYRK1A Q13627 1/20 0.46
▸ AURKB Q96GD4 1/20 0.46
▸ CLK4 Q9HAZ1 1/20 0.46
▸ STK17A Q9UEE5 1/20 0.46

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
SCHEMBL15639228 0.90 ROCK2 (0.80) ROCK2ROCK1SLC2A1SLC2A3CLK2
SCHEMBL17040533 0.88 ROCK2 (1.00) ROCK2ROCK1SLC2A1SLC2A3CLK2
Hydrochloric Acid SCHEMBL15639354 0.88 ROCK2 (0.98) ROCK2ROCK1SLC2A1SLC2A3CLK2
SCHEMBL17041162 0.85 ROCK2 (1.00) ROCK2ROCK1SLC2A1SLC2A3CLK2
SCHEMBL17040534 0.84 ROCK2 (1.00) ROCK2ROCK1SLC2A1SLC2A3CLK2
Hydrochloric Acid SCHEMBL15639743 0.83 ROCK2 (0.98) ROCK2ROCK1SLC2A1SLC2A3CLK2
SCHEMBL17025851 0.82 ROCK2 (0.75) ROCK2ROCK1MEN1KMT2ASLC2A1
SCHEMBL17025859 0.82 ROCK2 (0.75) ROCK2ROCK1SLC2A1SLC2A3
SCHEMBL24862414 0.79 ROCK2 (0.79) ROCK2ROCK1
SCHEMBL17038107 0.78 ROCK2 (1.00) ROCK2ROCK1SLC2A1SLC2A3CLK2

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-4116293-A2 RHO KINASE INHIBITORS Kadmon Corporation, LLC (US) 2023-01-11 — — EP disclosed
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