SCHEMBL6323246

SCHEMBL6323246

CCC(c1ccsc1)S(N)(=O)=O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.39
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA4 P43681 1/20 0.36
IDO1 P14902 1/20 0.34
TDO2 P48775 1/20 0.34
GRIA4 P48058 2/20 0.34
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
ADRB3 P13945 1/20 0.31
CA7 P43166 1/20 0.30
CA14 Q9ULX7 1/20 0.30

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
SCHEMBL3445147 0.82 ALOX5 (0.39) ALOX5CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL988364 0.73 LMNA (0.43) CA1CA2CA7CA14
SCHEMBL8354255 0.72 CHRNB2 (0.38) ALOX5CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL6323126 0.72 ALOX5 (0.35) ALOX5CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL6329644 0.72 ALOX5 (0.38) ALOX5CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL6330663 0.72 GRIA4 (0.36) ALOX5CHRNB2CHRNB4CHRNA3CHRNA4
Hydrochloric Acid SCHEMBL31111546 0.72 LMNA (0.42) CA1CA2CA7CA14
SCHEMBL8356434 0.71 CHRNB2 (0.37) ALOX5CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL3465616 0.71
SCHEMBL2009597 0.71

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-20050014840-A1 Thiol sulfonamide metalloprotease inhibitors PHARMACIA CORPORATION 2005-01-20 US disclosed
EP-0939629-A4 THIOL SULFONAMIDE METALLOPROTEASE INHIBITORS MONSANTO CO (US) 2002-07-17 EP disclosed
EP-0939629-A1 THIOL SULFONAMIDE METALLOPROTEASE INHIBITORS MONSANTO COMPANY (US) 1999-09-08 EP disclosed
WO-1998003166-A1 THIOL SULFONAMIDE METALLOPROTEASE INHIBITORS MONSANTO COMPANY (US) 1998-01-29 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-20050014840-A1 Thiol sulfonamide metalloprotease inhibitors MMP12, MMP13, MMP3 ALOX5 650/4885CHRNB2 4880/4885CHRNB4 4882/4885

“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.