SCHEMBL3059014

SCHEMBL3059014

NS(=O)(=O)CCc1ccc(S(=O)(=O)Cl)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.60
CA2 P00918 14/20 0.47
CA1 P00915 7/20 0.47
CA12 O43570 6/20 0.47
CA9 Q16790 6/20 0.47
CA14 Q9ULX7 4/20 0.47
CA4 P22748 3/20 0.47
CA6 P23280 3/20 0.47
CA5A P35218 3/20 0.47
CA7 P43166 3/20 0.47
CA5B Q9Y2D0 3/20 0.47
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ENPP1 P22413 1/20 0.41
F2 P00734 2/20 0.41
TMPRSS4 Q9NRS4 2/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 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
SCHEMBL23691266 0.83 ALDH1A1 (0.44) RECQLCA2CA1CA12CA9
SCHEMBL11582128 0.83 ALDH1A1 (0.52) CA2CA1CA12CA9CA14
SCHEMBL3065768 0.80 PTGS2 (0.45) RECQLCA2CA1CA12CA9
SCHEMBL852835 0.79 CA2 (0.67) CA2CA1CA12CA9CA14
SCHEMBL3059168 0.79 CA2 (0.56) CA2CA1CA12CA9CA14
SCHEMBL8113789 0.79 RECQL (0.64) RECQLCA2CA1CA12CA9
SCHEMBL14610271 0.78 GFER (0.58) RECQLCA2CA1CA12CA9
Fluoride SCHEMBL27875099 0.78 CA12 (0.64) CA2CA1CA12CA9CA14
SCHEMBL27568568 0.78 CA2 (0.63) RECQLCA2CA1CA12CA9
SCHEMBL11166463 0.77 RECQL (0.96) RECQLCA2CA1CA12CA9

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
US-7834049-B2 Sulfonamide compound for treating arteriosclerosis, psoriasis, colon cancer, retinal angiogenesis, diabetic retinopathy or inflammatory diseases EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-11-16 US disclosed
US-20100267754-A1 INTEGRIN EXPRESSION INHIBITOR WAKABAYASHI TOSHIAKI 2010-10-21 US disclosed
US-20050176712-A1 Integrin expression inhibitor EISAI CO., LTD. 2005-08-11 US disclosed
US-20040018192-A1 Integrin expression inhibitors EISAI CO., LTD. (JP) 2004-01-29 US disclosed
EP-0673937-B1 BICYCLIC HETEROCYCLIC SULFONAMIDE AND SULFONIC ESTER DERIVATIVES EISAI CO LTD (JP) 2003-11-26 EP disclosed
EP-1258252-A1 INTEGRIN EXPRESSION INHIBITORS Eisai Co., Ltd. (JP) 2002-11-20 EP disclosed
EP-0673937-A1 BICYCLIC HETEROCYCLIC SULFONAMIDE AND SULFONIC ESTER DERIVATIVES Eisai Co., Ltd. (JP) 1995-09-27 EP 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 (3 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-20050176712-A1 Integrin expression inhibitor ITGB5, ITGB1, ITGB2 RECQL 4732/4885CA2 821/4885CA1 867/4885
US-20100267754-A1 INTEGRIN EXPRESSION INHIBITOR ITGB5, ITGB1, ITGB2 RECQL 4732/4885CA2 821/4885CA1 867/4885
US-20040018192-A1 Integrin expression inhibitors ITGB1, ITGB4, ITGB5 RECQL 4766/4885CA2 631/4885CA1 827/4885

“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.