SCHEMBL6329644

SCHEMBL6329644

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

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.38
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA4 P43681 1/20 0.36
CXCR1 P25024 2/20 0.33
CXCR2 P25025 2/20 0.33
GRIA4 P48058 2/20 0.32

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
SCHEMBL6323126 0.86 ALOX5 (0.35) ALOX5CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL3445147 0.76 ALOX5 (0.39) ALOX5CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL6330663 0.75 GRIA4 (0.36) ALOX5CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL6323246 0.72 ALOX5 (0.39) ALOX5CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL6325882 0.70 TSHR (0.39)
SCHEMBL8354255 0.67 CHRNB2 (0.38) ALOX5CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL8605601 0.67 ALOX5 (0.41) ALOX5CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL22995905 0.67 ALOX5 (0.39) ALOX5CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL8428133 0.66
SCHEMBL14928671 0.66

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 2 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
US-6747027-B1 SELECTIVELY INHIBITS IN VITRO ACTIVITY OF HUMAN MATRIX METALLOPROTEASE-13 OVER IN VITRO ACTIVITY OF HUMAN MATRIX METALLOPROTEASE-1 PHARMACIA CORPORATION 2004-06-08 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-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.