SCHEMBL29778563

SCHEMBL29778563

[2H]C([2H])([2H])NC(=O)c1cccc(Cn2ccc3cc(-c4conc4C)ccc3c2=O)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.40
ROCK1 Q13464 1/20 0.40
LMNA P02545 6/20 0.37
KLKB1 P03952 2/20 0.36
MAP4K1 Q92918 1/20 0.36
MAPK1 P28482 1/20 0.36
HSP90AB1 P08238 1/20 0.35
RXFP1 Q9HBX9 2/20 0.35
YTHDC1 Q96MU7 1/20 0.35
TP53 P04637 2/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL24617245 0.94 ROCK2 (0.42) ROCK2ROCK1LMNAKLKB1MAP4K1
SCHEMBL29779099 0.88 ROCK2 (0.43) ROCK2ROCK1LMNAHSP90AB1YTHDC1
SCHEMBL24617178 0.88 ROCK2 (0.43) ROCK2ROCK1LMNAHSP90AB1YTHDC1
SCHEMBL29778605 0.88 ROCK2 (0.40) ROCK2ROCK1LMNAKLKB1MAP4K1
SCHEMBL24617414 0.88 ROCK2 (0.40) ROCK2ROCK1LMNAKLKB1MAP4K1
SCHEMBL29779014 0.87 ROCK2 (0.45) ROCK2ROCK1LMNAHSP90AB1YTHDC1
SCHEMBL24617067 0.86 KLKB1 (0.39) ROCK2ROCK1LMNAKLKB1MAP4K1
SCHEMBL29778522 0.86 TP53 (0.45) ROCK2ROCK1LMNARXFP1TP53
SCHEMBL24617349 0.86 TP53 (0.45) ROCK2ROCK1LMNARXFP1TP53
SCHEMBL29778594 0.86 KLKB1 (0.39) ROCK2ROCK1LMNAKLKB1MAP4K1

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-20240374582-A1 SELECTIVE INHIBITORS OF ROCK1 AND ROCK2 PROTEIN KINASES AND THEIR USES THEREOF Genosco Inc. 2024-11-14 US claimed
EP-4274825-A1 SELECTIVE INHIBITORS OF ROCK1 AND ROCK2 PROTEIN KINASES AND USES THEREOF Genosco Inc. (US) 2023-11-15 EP claimed
WO-2022150381-A1 SELECTIVE INHIBITORS OF ROCK1 AND ROCK2 PROTEIN KINASES AND USES THEREOF Genosco Inc. (US) 2022-07-14 WO claimed
US-20240374582-A1 SELECTIVE INHIBITORS OF ROCK1 AND ROCK2 PROTEIN KINASES AND THEIR USES THEREOF Genosco Inc. 2024-11-14 US disclosed
EP-4274825-A1 SELECTIVE INHIBITORS OF ROCK1 AND ROCK2 PROTEIN KINASES AND USES THEREOF Genosco Inc. (US) 2023-11-15 EP disclosed
WO-2022150381-A1 SELECTIVE INHIBITORS OF ROCK1 AND ROCK2 PROTEIN KINASES AND USES THEREOF Genosco Inc. (US) 2022-07-14 WO 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-20240374582-A1 SELECTIVE INHIBITORS OF ROCK1 AND ROCK2 PROTEIN KINASES AND THEIR USES THEREOF ROCK2, ROCK1, MYLK3 ROCK2 1/4885ROCK1 2/4885LMNA 1865/4885

“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.