SCHEMBL24464193

SCHEMBL24464193

N=Cc1cc(Nc2ccnc(-c3cccc(C(=O)NC4CCOCC4)c3)n2)ccc1N

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 15/20 0.66
▸ ROCK1 Q13464 12/20 0.66
▸ ATR Q13535 1/20 0.47
▸ CCNE1 P24864 2/20 0.41
▸ CDK2 P24941 2/20 0.41
▸ LRRK2 Q5S007 1/20 0.41

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
SCHEMBL21451348 0.90 ROCK2 (0.67) ROCK2ROCK1CCNE1CDK2
SCHEMBL17038115 0.89 ROCK2 (0.67) ROCK2ROCK1ATRCCNE1CDK2
SCHEMBL24464148 0.89 ROCK2 (0.53) ROCK2ROCK1CCNE1CDK2
SCHEMBL24464173 0.84 NPC1 (0.50) ROCK2ROCK1
SCHEMBL24464163 0.84 ROCK2 (0.53) ROCK2ROCK1CCNE1CDK2
SCHEMBL24862335 0.81 KDR (0.44) ROCK2ROCK1
SCHEMBL24464147 0.80 ROCK1 (0.57) ROCK2ROCK1
SCHEMBL24464164 0.80 ROCK2 (0.49) ROCK2ROCK1
SCHEMBL24353607 0.80 ROCK2 (0.67) ROCK2ROCK1
SCHEMBL17038114 0.79 ROCK2 (1.00) 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
US-20220395501-A1 TREATMENT OF GVHD KADMON CORP LLC (US) 2022-12-15 — — US disclosed
EP-2903618-B1 RHO KINASE INHIBITORS KADMON CORP LLC (US) 2022-06-01 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220395501-A1 TREATMENT OF GVHD ROCK2, ROCK1, RHOXF2 ROCK2 1/4885ROCK1 2/4885ATR 3127/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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