SCHEMBL353679

SCHEMBL353679

Cc1noc(C)c1C(=O)NC(CO)c1csc(NC(=O)NCc2cccc(F)c2)n1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 8/20 0.51
ROCK1 Q13464 7/20 0.51
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
GAA P10253 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
LMNA P02545 1/20 0.41
THRB P10828 1/20 0.41
EPHX2 P34913 1/20 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
SCHEMBL352586 0.90 ROCK2 (0.52) ROCK2ROCK1NPC1RAB9AGAA
SCHEMBL19119169 0.88 ROCK1 (0.49) ROCK2ROCK1ATG4BEPHX2
SCHEMBL354655 0.81 ROCK2 (0.47) ROCK2ROCK1NPC1RAB9AGAA
SCHEMBL19118881 0.80 ROCK1 (0.50) ROCK2ROCK1ATG4BEPHX2
SCHEMBL355123 0.79 ROCK2 (0.51) ROCK2ROCK1NPC1RAB9AGAA
SCHEMBL353824 0.78 ROCK1 (0.62) ROCK2ROCK1ATG4B
SCHEMBL352247 0.77 ROCK2 (0.47) ROCK2ROCK1NPC1RAB9AGAA
SCHEMBL19119022 0.77 ROCK2 (0.59) ROCK2ROCK1ATG4BEPHX2
SCHEMBL19118707 0.77 ROCK1 (0.63) ROCK2ROCK1ATG4BEPHX2
SCHEMBL354195 0.76 ROCK1 (0.54) ROCK2ROCK1NPC1RAB9AATG4B

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 4747/4885NPC1 3444/4885

“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.