SCHEMBL3071805

SCHEMBL3071805

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

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 8/20 0.57
BRD1 O95696 1/20 0.53
BRPF1 P55201 1/20 0.53
PGR P06401 1/20 0.51
HTR6 P50406 1/20 0.51
GLO1 Q04760 1/20 0.49
SLC40A1 Q9NP59 1/20 0.49
HSPD1 P10809 1/20 0.48
PTPN2 P17706 1/20 0.48
PTPN1 P18031 1/20 0.48
PTPN5 P54829 1/20 0.48
HSPE1 P61604 1/20 0.48
BRD4 O60885 1/20 0.48
SGK1 O00141 2/20 0.47
ACLY P53396 1/20 0.47
HSD17B1 P14061 1/20 0.46
HSD17B2 P37059 1/20 0.46
TRIM24 O15164 1/20 0.46
MAPT P10636 1/20 0.46
IKBKB O14920 1/20 0.45

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
SCHEMBL3068871 0.88 SCN9A (0.51) SCN9ABRD1BRPF1BRD4MAPT
SCHEMBL3070368 0.85 MEN1 (0.56) SCN9ASLC40A1PTPN2PTPN1PTPN5
SCHEMBL3062422 0.81 KEAP1 (0.57) SCN9ASLC40A1IKBKBJAK2
SCHEMBL3062102 0.79 ALDH1A1 (0.56) SCN9AMAPTIKBKBJAK2
SCHEMBL3065940 0.78 SCN9A (0.52) SCN9AMAPTIKBKBJAK2
SCHEMBL3072040 0.78 LMNA (0.54) SCN9AIKBKBJAK2
SCHEMBL3060882 0.76 IKBKB (0.50) SCN9AMAPTIKBKBJAK2
SCHEMBL3050929 0.75 IKBKB (0.47) SCN9AIKBKBJAK2
SCHEMBL3072126 0.75 GAA (0.65) IKBKBJAK2
SCHEMBL3072044 0.75 SCN9A (0.50) SCN9AIKBKBJAK2

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 SCN9A 243/4885BRD1 262/4885BRPF1 876/4885
US-20100267754-A1 INTEGRIN EXPRESSION INHIBITOR ITGB5, ITGB1, ITGB2 SCN9A 243/4885BRD1 262/4885BRPF1 876/4885
US-20040018192-A1 Integrin expression inhibitors ITGB1, ITGB4, ITGB5 SCN9A 276/4885BRD1 382/4885BRPF1 1552/4885
US-20030144507-A1 Sulfonamide-containing heterocyclic compounds SLC5A2, SLC5A1, CBR3 SCN9A 168/4885BRD1 645/4885BRPF1 4477/4885

“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.