SCHEMBL3384100

SCHEMBL3384100

COc1cc(-c2cn[nH]c2)cc2c(O)nc(C3COc4ccc(Cl)cc4C3)nc12

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 20/20 0.58
▸ ROCK1 Q13464 1/20 0.51

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
SCHEMBL3387505 0.91 ROCK2 (0.70) ROCK2ROCK1
SCHEMBL13362724 0.91 ROCK2 (0.70) ROCK2ROCK1
SCHEMBL3388887 0.90 ROCK2 (0.70) ROCK2ROCK1
SCHEMBL3388712 0.84 ROCK2 (0.64) ROCK2
SCHEMBL3387979 0.81 ROCK2 (0.74) ROCK2ROCK1
SCHEMBL3383971 0.81 ROCK2 (0.46) ROCK2ROCK1
SCHEMBL13362764 0.80 ROCK2 (0.69) ROCK2ROCK1
SCHEMBL3381886 0.80 ROCK2 (0.59) ROCK2ROCK1
SCHEMBL3384106 0.79 ROCK2 (0.55) ROCK2ROCK1
SCHEMBL3432596 0.78 ROCK2 (0.65) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010056758-A1 QUINAZOLINE DERIVATIVES AS KINASE INHIBITORS FENG YANGBO (US) 2010-05-20 — — WO disclosed
WO-2010056758-A1 QUINAZOLINE DERIVATIVES AS KINASE INHIBITORS FENG YANGBO (US) 2010-05-20 — — WO disclosed
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