SCHEMBL7096840

SCHEMBL7096840

COc1ccc(C(=S)NC(=N)c2cccc(CN(C(=O)Nc3ccc(-c4ccccc4S(N)(=O)=O)cc3)C(C)C)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.46
F10 P00742 19/20 0.45
PRSS1 P07477 3/20 0.45

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
SCHEMBL7100398 0.94 F10 (0.43) ROCK2F10PRSS1
SCHEMBL7096906 0.91 F10 (0.46) ROCK2F10PRSS1
SCHEMBL7098172 0.91 F10 (0.45) F10PRSS1
SCHEMBL7094508 0.91 F10 (0.49) F10PRSS1
SCHEMBL7097783 0.90 F10 (0.45) ROCK2F10PRSS1
SCHEMBL7083708 0.90 F10 (0.43) F10PRSS1
SCHEMBL7096630 0.89 F10 (0.45) F10PRSS1
SCHEMBL7070281 0.89 F10 (0.43) F10PRSS1
SCHEMBL7093555 0.89 F10 (0.46) F10PRSS1
SCHEMBL7097270 0.87 SCN9A (0.46) ROCK2F10PRSS1

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-20030171579-A1 Urethane derivatives MERCK PATENT GMBH (DE) 2003-09-11 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-20030171579-A1 Urethane derivatives UTS2R, PLAUR, IL1A ROCK2 3600/4885F10 42/4885PRSS1 371/4885

“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.