SCHEMBL4725532

SCHEMBL4725532

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

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
ROCK1 Q13464 11/20 0.46
ROCK2 O75116 9/20 0.46
MAPK1 P28482 5/20 0.45
RAB9A P51151 1/20 0.42
ABL1 P00519 1/20 0.41

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
SCHEMBL4726382 0.93 ROCK1 (0.46) MEN1MAPTKMT2AROCK1ROCK2
SCHEMBL4777271 0.92 ROCK1 (0.48) ROCK1ROCK2MAPK1
SCHEMBL4726471 0.91 ROCK1 (0.47) ROCK1ROCK2MAPK1
SCHEMBL4725491 0.91 ROCK1 (0.47) ROCK1ROCK2MAPK1
SCHEMBL4776809 0.87 ROCK1 (0.46) ROCK1ROCK2MAPK1RAB9A
SCHEMBL4779953 0.87 ROCK1 (0.58) MAPTROCK1ROCK2RAB9A
SCHEMBL4777375 0.86 TRPV1 (0.46) ROCK1ROCK2
SCHEMBL4725670 0.86 ROCK2 (0.55) MEN1MAPTKMT2AROCK1ROCK2
SCHEMBL4726541 0.86 ROCK1 (0.48) MAPTROCK1ROCK2RAB9A
SCHEMBL4780457 0.86 ROCK1 (0.45) ROCK1ROCK2MAPK1

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 MEN1 2838/4885MAPT 2119/4885KMT2A 3349/4885

“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.