SCHEMBL4777375

SCHEMBL4777375

COCCOCc1csc(NC(=O)NCc2ccc(Cl)c(C(F)(F)F)c2)n1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.46
ROCK1 Q13464 10/20 0.44
ROCK2 O75116 7/20 0.44
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
SCD O00767 1/20 0.41
P2RX7 Q99572 3/20 0.41
SCN3A Q9NY46 1/20 0.40
NR3C1 P04150 2/20 0.39

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
SCHEMBL4777271 0.89 ROCK1 (0.48) TRPV1ROCK1ROCK2
SCHEMBL4726382 0.88 ROCK1 (0.46) ROCK1ROCK2
SCHEMBL4726471 0.88 ROCK1 (0.47) TRPV1ROCK1ROCK2
SCHEMBL4725491 0.88 ROCK1 (0.47) TRPV1ROCK1ROCK2
SCHEMBL4776809 0.86 ROCK1 (0.46) ROCK1ROCK2
SCHEMBL4725532 0.86 MEN1 (0.46) ROCK1ROCK2
SCHEMBL4780457 0.84 ROCK1 (0.45) TRPV1ROCK1ROCK2
SCHEMBL4779953 0.83 ROCK1 (0.58) ROCK1ROCK2
SCHEMBL4726466 0.82 ROCK1 (0.49) ROCK1ROCK2
SCHEMBL4725670 0.82 ROCK2 (0.55) ROCK1ROCK2

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-8716320-B2 Antibacteriall heterocyclic ureas REPLIDYNE, INC. (US) 2014-05-06 US claimed
US-20080207703-A1 Antibacterial heterocyclic ureas REPLIDYNE, INC. (US) 2008-08-28 US claimed
WO-2008011191-A1 ANTIBACTERIAL HETEROCYCLIC UREAS REPLIDYNE, INC. (US) 2008-01-24 WO claimed
US-8716320-B2 Antibacteriall heterocyclic ureas REPLIDYNE, INC. (US) 2014-05-06 US disclosed
US-20080207703-A1 Antibacterial heterocyclic ureas REPLIDYNE, INC. (US) 2008-08-28 US disclosed
WO-2008011191-A1 ANTIBACTERIAL HETEROCYCLIC UREAS REPLIDYNE, INC. (US) 2008-01-24 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-20080207703-A1 Antibacterial heterocyclic ureas UMPS, UROD, UGP2 TRPV1 3935/4885ROCK1 4331/4885ROCK2 4405/4885

“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.