SCHEMBL3072126

SCHEMBL3072126

COc1nccc2cc(NS(=O)(=O)c3ccc(NC(C)=O)cc3)ccc12

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.65
SMN1; SMN2 Q16637 3/20 0.59
LMNA P02545 2/20 0.59
HTT P42858 2/20 0.59
ALOX15 P16050 1/20 0.59
MAPK1 P28482 1/20 0.59
IKBKB O14920 1/20 0.56
JAK2 O60674 1/20 0.56
ALDH1A1 P00352 3/20 0.54
KDM4E B2RXH2 3/20 0.54
PKM P14618 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
AKT1 P31749 1/20 0.53
POLB P06746 1/20 0.51

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 0.86 ALDH1A1 (0.56) GAASMN1; SMN2LMNAHTTIKBKB
SCHEMBL3060711 0.86 IKBKB (0.53) GAASMN1; SMN2LMNAHTTALOX15
SCHEMBL3072040 0.85 LMNA (0.54) GAASMN1; SMN2LMNAHTTMAPK1
SCHEMBL3065940 0.85 SCN9A (0.52) GAALMNAIKBKBJAK2ALDH1A1
SCHEMBL3060882 0.83 IKBKB (0.50) GAASMN1; SMN2LMNAIKBKBJAK2
SCHEMBL3068871 0.82 SCN9A (0.51) GAASMN1; SMN2LMNAHTTIKBKB
SCHEMBL3072044 0.80 SCN9A (0.50) LMNAMAPK1IKBKBJAK2ALDH1A1
SCHEMBL3050929 0.80 IKBKB (0.47) IKBKBJAK2MEN1KMT2A
SCHEMBL3061244 0.79 SCN9A (0.54) IKBKBJAK2PKM
SCHEMBL3062422 0.79 KEAP1 (0.57) GAAIKBKBJAK2KMT2A

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 GAA 4822/4885SMN1; SMN2 2639/4885LMNA 3673/4885
US-20100267754-A1 INTEGRIN EXPRESSION INHIBITOR ITGB5, ITGB1, ITGB2 GAA 4822/4885SMN1; SMN2 2639/4885LMNA 3673/4885
US-20040018192-A1 Integrin expression inhibitors ITGB1, ITGB4, ITGB5 GAA 4676/4885SMN1; SMN2 2404/4885LMNA 3427/4885
US-20030144507-A1 Sulfonamide-containing heterocyclic compounds SLC5A2, SLC5A1, CBR3 GAA 2149/4885SMN1; SMN2 1987/4885LMNA 3807/4885

“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.