SCHEMBL3070368

SCHEMBL3070368

COc1nccc2cc(NS(=O)(=O)c3cccc(C)c3)ccc12

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
SCN9A Q15858 10/20 0.48
IKBKB O14920 1/20 0.48
JAK2 O60674 1/20 0.48
KIT P10721 1/20 0.47
SLC40A1 Q9NP59 1/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47
PTPN2 P17706 2/20 0.47
PTPN1 P18031 2/20 0.47
PTPN5 P54829 2/20 0.47

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
SCHEMBL3062102 0.87 ALDH1A1 (0.56) MEN1KMT2ASCN9AIKBKBJAK2
SCHEMBL3071805 0.85 SCN9A (0.57) SCN9AIKBKBJAK2SLC40A1MAPT
SCHEMBL3062422 0.84 KEAP1 (0.57) KMT2ASCN9AIKBKBJAK2SLC40A1
SCHEMBL3065940 0.81 SCN9A (0.52) MEN1KMT2ASCN9AIKBKBJAK2
SCHEMBL3072040 0.81 LMNA (0.54) MEN1KMT2ASCN9AIKBKBJAK2
SCHEMBL3060882 0.80 IKBKB (0.50) SCN9AIKBKBJAK2ALDH1A1MAPT
SCHEMBL3050929 0.79 IKBKB (0.47) MEN1KMT2ASCN9AIKBKBJAK2
SCHEMBL3072126 0.79 GAA (0.65) MEN1KMT2AIKBKBJAK2ALDH1A1
SCHEMBL3068871 0.79 SCN9A (0.51) MEN1KMT2ASCN9AIKBKBJAK2
SCHEMBL3072044 0.79 SCN9A (0.50) SCN9AIKBKBJAK2ALDH1A1

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 9 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
EP-1243583-B1 HETEROCYCLIC COMPOUNDS HAVING SULFONAMIDE GROUPS EISAI CO LTD (JP) 2005-09-28 EP disclosed
US-20050176712-A1 Integrin expression inhibitor EISAI CO., LTD. 2005-08-11 US disclosed
US-6787534-B2 SUBSTITUTED QUINOLINE AND ISOQUINOLINE ANTIANGIOGENIC AGENTS; SULFONYLUREAS EISAI CO., LTD. (JP) 2004-09-07 US disclosed
US-20040018192-A1 Integrin expression inhibitors EISAI CO., LTD. (JP) 2004-01-29 US disclosed
US-20030144507-A1 Sulfonamide-containing heterocyclic compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2003-07-31 US disclosed
EP-1258252-A1 INTEGRIN EXPRESSION INHIBITORS Eisai Co., Ltd. (JP) 2002-11-20 EP disclosed
EP-1243583-A1 HETEROCYCLIC COMPOUNDS HAVING SULFONAMIDE GROUPS Eisai Co., Ltd. (JP) 2002-09-25 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 (4 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 MEN1 2665/4885KMT2A 2009/4885SCN9A 243/4885
US-20100267754-A1 INTEGRIN EXPRESSION INHIBITOR ITGB5, ITGB1, ITGB2 MEN1 2665/4885KMT2A 2009/4885SCN9A 243/4885
US-20040018192-A1 Integrin expression inhibitors ITGB1, ITGB4, ITGB5 MEN1 3218/4885KMT2A 2523/4885SCN9A 276/4885
US-20030144507-A1 Sulfonamide-containing heterocyclic compounds SLC5A2, SLC5A1, CBR3 MEN1 3262/4885KMT2A 1187/4885SCN9A 168/4885

“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.