SCHEMBL2011357

SCHEMBL2011357

Cc1cnc(O)c2cccc(S(=O)(=O)N3CC[C@@H](N)C3)c12

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 5/20 0.43
FEN1 P39748 5/20 0.43
ROCK2 O75116 9/20 0.37
ROCK1 Q13464 9/20 0.37
CNR1 P21554 1/20 0.37
COMT P21964 2/20 0.36
BRD4 O60885 1/20 0.36
HTR2B P41595 1/20 0.36
HTR6 P50406 1/20 0.36

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
SCHEMBL2010640 1.00 ALOX5AP (0.43) ALOX5APFEN1ROCK2ROCK1CNR1
SCHEMBL2010637 1.00 ALOX5AP (0.43) ALOX5APFEN1ROCK2ROCK1CNR1
SCHEMBL2007211 0.87 ALOX5AP (0.49) ALOX5APFEN1COMT
SCHEMBL2001292 0.87 ALOX5AP (0.43) ALOX5APFEN1ROCK2ROCK1COMT
SCHEMBL2007210 0.87 ALOX5AP (0.49) ALOX5APFEN1COMT
SCHEMBL1999353 0.87 ALOX5AP (0.43) ALOX5APFEN1ROCK2ROCK1CNR1
SCHEMBL1999039 0.87 ALOX5AP (0.43) ALOX5APFEN1ROCK2ROCK1COMT
SCHEMBL2005716 0.87 ALOX5AP (0.43) ALOX5APFEN1ROCK2ROCK1CNR1
SCHEMBL2008831 0.87 ALOX5AP (0.49) ALOX5APFEN1COMT
SCHEMBL1999037 0.87 ALOX5AP (0.43) ALOX5APFEN1ROCK2ROCK1COMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1932841-B1 SULFONAMIDE COMPOUND ASAHI KASEI PHARMA CORP (JP) 2014-01-01 EP disclosed
US-7964613-B2 (S)-3-amino-1-(4-bromo-5-isoquinolinesulfonyl)pyrrolidine; inhibits phosphorylation of myosin regulatory light chain; for spinal canal stenosis, spinal cord injury, rheumatoid arthritis, multiple sclerosis; Rho kinase inhibitors ASAHI KASEI PHARMA CORPORATION (JP) 2011-06-21 US disclosed
EP-2130828-A1 SULFONAMIDE DERIVATIVE Asahi Kasei Pharma Corporation (JP) 2009-12-09 EP disclosed
US-7618984-B2 Sulfonamide compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-11-17 US disclosed
US-20090048223-A1 Sulfonamide compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-02-19 US disclosed
EP-1932841-A1 SULFONAMIDE COMPOUND Asahi Kasei Pharma Corporation (JP) 2008-06-18 EP disclosed
US-20070179127-A1 Sulfonamide compound ASAHI KASEI PHARMA CORPORATION (JP) 2007-08-02 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 (2 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-20070179127-A1 Sulfonamide compound MYLK, MYLK2, MYLK3 ALOX5AP 4520/4885FEN1 4586/4885ROCK2 332/4885
US-20090048223-A1 Sulfonamide compound ALK, AKT1, ARAF ALOX5AP 3609/4885FEN1 4520/4885ROCK2 16/4885

“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.