SCHEMBL24736591

SCHEMBL24736591

CN(C)Cc1cc(C(CN)C(=O)Nc2ccc3cnccc3c2)ccc1B(O)O

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 20/20 0.69
▸ ROCK1 Q13464 3/20 0.69
▸ MYLK4 Q86YV6 1/20 0.62

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
SCHEMBL24736111 0.94 ROCK2 (0.68) ROCK2ROCK1MYLK4
SCHEMBL24736042 0.88 ROCK2 (0.68) ROCK2ROCK1
SCHEMBL22898421 0.87 ROCK2 (0.78) ROCK2ROCK1MYLK4
SCHEMBL24736043 0.86 ROCK2 (0.80) ROCK2ROCK1MYLK4
SCHEMBL22898423 0.85 ROCK2 (0.75) ROCK2ROCK1MYLK4
SCHEMBL24736339 0.84 ROCK2 (0.79) ROCK2ROCK1MYLK4
SCHEMBL24736341 0.84 ROCK2 (0.80) ROCK2ROCK1MYLK4
SCHEMBL24735985 0.83 ROCK2 (0.66) ROCK2ROCK1
SCHEMBL24736338 0.83 ROCK2 (0.68) ROCK2ROCK1
SCHEMBL22898365 0.82 ROCK2 (1.00) ROCK2ROCK1MYLK4

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
US-20220389035-A1 BORON-CONTAINING RHO KINASE INHIBITORS PERCIPIAD, INC. 2022-12-08 — — US 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-20220389035-A1 BORON-CONTAINING RHO KINASE INHIBITORS ROCK1, ROCK2, RHOT2 ROCK2 2/4885ROCK1 1/4885MYLK4 96/4885

“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.

Send feedback