SCHEMBL29478441

SCHEMBL29478441

NC[C@H](C(=O)Nc1ccc2cnccc2c1)c1ccc(Cl)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 20/20 1.00
ROCK1 Q13464 3/20 0.79
MYLK4 Q86YV6 1/20 0.78

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
SCHEMBL30518356 1.00 ROCK2 (1.00) ROCK2ROCK1MYLK4
SCHEMBL16041166 1.00 ROCK2 (1.00) ROCK2ROCK1MYLK4
SCHEMBL16041168 1.00 ROCK2 (1.00) ROCK2ROCK1MYLK4
SCHEMBL29478448 1.00 ROCK2 (1.00) ROCK2ROCK1MYLK4
SCHEMBL16042678 1.00 ROCK2 (1.00) ROCK2ROCK1MYLK4
SCHEMBL29478430 0.95 ROCK2 (0.90) ROCK2ROCK1MYLK4
SCHEMBL16040143 0.95 ROCK2 (0.90) ROCK2ROCK1MYLK4
SCHEMBL16040142 0.95 ROCK2 (0.90) ROCK2ROCK1MYLK4
SCHEMBL13074858 0.90 ROCK2 (1.00) ROCK2ROCK1MYLK4
SCHEMBL24336110 0.89 ROCK2 (0.81) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220088000-A1 COMBINATION THERAPY ALCON INC. (CH) 2022-03-24 US claimed
CN-110396085-B Combination therapy 爱尔康公司 2024-11-15 CN disclosed
EP-4335507-A2 COMBINATION THERAPY Aerie Pharmaceuticals, Inc. (US) 2024-03-13 EP disclosed
CN-117050013-A Mono (acid) salts of 6-aminoisoquinolines and use thereof 爱瑞制药公司 2023-11-14 CN disclosed
CN-111936139-B Mono (acid) salts of 6-aminoisoquinolines and use thereof 爱瑞制药公司 2023-10-13 CN disclosed
EP-4218759-A2 COMBINATION THERAPY Aerie Pharmaceuticals, Inc. (US) 2023-08-02 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-20220088000-A1 COMBINATION THERAPY PTGS1, PTGS2, PTGIS ROCK2 110/4885ROCK1 159/4885MYLK4 594/4885

“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.