SCHEMBL3511157

SCHEMBL3511157

Cc1ccc(S(=O)(=O)Cc2csc(NC(=O)NCc3ccc(Cl)c(Cl)c3)n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK1 Q13464 7/20 0.48
ROCK2 O75116 6/20 0.48
RORC P51449 3/20 0.42
ALDH1A1 P00352 2/20 0.42
HTT P42858 1/20 0.42
TRPV1 Q8NER1 1/20 0.41
CLK1 P49759 1/20 0.41
MAPT P10636 2/20 0.41
NAMPT P43490 1/20 0.41
AKT1 P31749 2/20 0.41
GSK3B P49841 2/20 0.41
LIMK1 P53667 2/20 0.41
CDC42BPA Q5VT25 2/20 0.41
SGK1 O00141 1/20 0.41
TNK2 Q07912 1/20 0.41
DMPK Q09013 1/20 0.41
MYLK Q15746 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 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
SCHEMBL3511581 0.92 ROCK1 (0.50) ROCK1ROCK2RORCTRPV1NAMPT
SCHEMBL3512717 0.91 ROCK2 (0.47) ROCK1ROCK2RORCMAPTNAMPT
SCHEMBL3512328 0.91 ROCK1 (0.41) ROCK1ROCK2RORCALDH1A1TRPV1
SCHEMBL3508218 0.91 ROCK1 (0.48) ROCK1ROCK2RORCTRPV1CLK1
SCHEMBL3512275 0.90 ROCK1 (0.51) ROCK1ROCK2RORCNAMPTGSK3B
SCHEMBL3513516 0.90 ROCK2 (0.50) ROCK1ROCK2TRPV1MAPTNAMPT
SCHEMBL3512613 0.90 RORC (0.41) ROCK1ROCK2RORCTRPV1NAMPT
SCHEMBL3513135 0.90 ROCK1 (0.49) ROCK1ROCK2ALDH1A1TRPV1MAPT
SCHEMBL3513182 0.88 NAMPT (0.42) ROCK1ROCK2RORCNAMPTAKT1
SCHEMBL3513585 0.87 ROCK1 (0.54) ROCK1ROCK2ALDH1A1MAPTNAMPT

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-8293919-B2 Antibacterial sulfone and sulfoxide substituted heterocyclic urea compounds CRESTONE, INC. (US) 2012-10-23 US claimed
US-20100286169-A1 Antibacterial Sulfone and Sulfoxide Substituted Heterocyclic Urea Compounds CRESTONE, INC. (US) 2010-11-11 US claimed
WO-2009015193-A1 ANTIBACTERIAL SULFONE AND SULFOXIDE SUBSTITUTED HETEROCYCLIC UREA COMPOUNDS REPLIDYNE, INC. (US) 2009-01-29 WO claimed
US-8293919-B2 Antibacterial sulfone and sulfoxide substituted heterocyclic urea compounds CRESTONE, INC. (US) 2012-10-23 US disclosed
US-20100286169-A1 Antibacterial Sulfone and Sulfoxide Substituted Heterocyclic Urea Compounds CRESTONE, INC. (US) 2010-11-11 US disclosed
WO-2009015193-A1 ANTIBACTERIAL SULFONE AND SULFOXIDE SUBSTITUTED HETEROCYCLIC UREA COMPOUNDS REPLIDYNE, INC. (US) 2009-01-29 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-20100286169-A1 Antibacterial Sulfone and Sulfoxide Substituted Heterocyclic Urea Compounds TST, UMPS, UROD ROCK1 4658/4885ROCK2 4700/4885RORC 1850/4885

“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.