SCHEMBL23927641

SCHEMBL23927641

NCC(C(=O)Nc1ccc2cnccc2c1)c1ccccc1CO[N+](=O)[O-]

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 20/20 0.67
ROCK1 Q13464 9/20 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
SCHEMBL23963838 0.83 ROCK2 (0.81) ROCK2ROCK1
SCHEMBL28404271 0.83 ROCK2 (0.73) ROCK2ROCK1
SCHEMBL118440 0.82 ROCK2 (0.68) ROCK2ROCK1
SCHEMBL19886421 0.81 ROCK2 (1.00) ROCK2ROCK1
SCHEMBL19886628 0.80 ROCK2 (1.00) ROCK2ROCK1
SCHEMBL19886629 0.80 ROCK2 (1.00) ROCK2ROCK1
SCHEMBL19886626 0.80 ROCK2 (1.00) ROCK2ROCK1
SCHEMBL19886420 0.77 ROCK2 (1.00) ROCK2ROCK1
SCHEMBL21514522 0.77 ROCK2 (1.00) ROCK2ROCK1
SCHEMBL21514529 0.77 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-20220332726-A1 NITROXIDE DERIVATIVE OF ROCK KINASE INHIBITOR VIVAVISION (SHANGHAI) LTD (CN) 2022-10-20 US disclosed
EP-3901156-A1 NITROOXYDERIVATIVE OF ROCK KINASE INHIBITOR Vivavision (Shanghai) Ltd (CN) 2021-10-27 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-20220332726-A1 NITROXIDE DERIVATIVE OF ROCK KINASE INHIBITOR ROCK1, NOS1, ROCK2 ROCK2 3/4885ROCK1 1/4885

“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.