SCHEMBL352641

SCHEMBL352641

CN(Cc1csc(NC(=O)NCc2cccc(F)c2)n1)C(=O)c1c[nH]nc1N

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 12/20 0.50
ROCK1 Q13464 12/20 0.50
MAPK1 P28482 2/20 0.43
ATG4B Q9Y4P1 1/20 0.40
AURKA O14965 1/20 0.40
AURKB Q96GD4 1/20 0.40
NAMPT P43490 2/20 0.40

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
SCHEMBL353338 0.91 ROCK2 (0.51) ROCK2ROCK1MAPK1ATG4BNAMPT
SCHEMBL19119241 0.88 ROCK2 (0.49) ROCK2ROCK1MAPK1ATG4BNAMPT
SCHEMBL353620 0.85 ROCK2 (0.50) ROCK2ROCK1MAPK1ATG4BNAMPT
SCHEMBL352294 0.85 ROCK2 (0.51) ROCK2ROCK1MAPK1ATG4BAURKA
SCHEMBL353532 0.84 ROCK2 (0.54) ROCK2ROCK1ATG4B
SCHEMBL353533 0.84 ROCK2 (0.50) ROCK2ROCK1MAPK1ATG4BNAMPT
SCHEMBL885401 0.84 ROCK2 (0.51) ROCK2ROCK1ATG4BNAMPT
SCHEMBL351601 0.83 ROCK2 (0.53) ROCK2ROCK1MAPK1ATG4B
SCHEMBL353707 0.83 ROCK2 (0.53) ROCK2ROCK1MAPK1ATG4BNAMPT
SCHEMBL353015 0.83 ROCK2 (0.52) ROCK2ROCK1MAPK1ATG4BNAMPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8148380-B2 Antibacterial amide and sulfonamide substituted heterocyclic urea compounds CRESTONE, INC. (US) 2012-04-03 US claimed
US-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds CRESTONE, INC. (US) 2012-01-19 US claimed
US-8148380-B2 Antibacterial amide and sulfonamide substituted heterocyclic urea compounds CRESTONE, INC. (US) 2012-04-03 US disclosed
US-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds CRESTONE, INC. (US) 2012-01-19 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-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds NAAA, AADAC, RPSA ROCK2 4626/4885ROCK1 4747/4885MAPK1 3630/4885

“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.