SCHEMBL3066019

SCHEMBL3066019

O=S(=O)(Nc1cccc2cc[nH]c12)c1cccc(Cl)c1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC40A1 Q9NP59 1/20 0.57
PGR P06401 6/20 0.57
NR3C1 P04150 1/20 0.57
NR3C2 P08235 1/20 0.57
AR P10275 1/20 0.57
MAP3K20 Q9NYL2 1/20 0.48
ACLY P53396 2/20 0.48
FBP1 P09467 1/20 0.47
PTGES2 Q9H7Z7 1/20 0.46
KDM1A O60341 1/20 0.46
MAOA P21397 1/20 0.46
PKM P14618 1/20 0.46

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
SCHEMBL2367735 0.86 NR3C1 (0.60) SLC40A1PGRNR3C1NR3C2AR
SCHEMBL2367383 0.84 NR3C1 (0.65) SLC40A1PGRNR3C1NR3C2AR
SCHEMBL3060588 0.78 GAA (0.57) SLC40A1PGRNR3C1NR3C2AR
SCHEMBL1984869 0.78 CA1 (0.60) PGRNR3C1NR3C2ARACLY
SCHEMBL2367682 0.78 NR3C1 (0.64) SLC40A1PGRNR3C1NR3C2AR
SCHEMBL3067241 0.77 CA1 (0.70) SLC40A1PGRNR3C1NR3C2AR
SCHEMBL1207409 0.77 SLC40A1 (0.62) SLC40A1PGRNR3C1NR3C2AR
SCHEMBL3063245 0.77 ALDH1A1 (0.51) PGRNR3C1NR3C2ARACLY
SCHEMBL7491194 0.75 BRD4 (0.57) SLC40A1PGRNR3C1ACLY
SCHEMBL2367583 0.75 NFKBIA (0.58) PGRNR3C1NR3C2AR

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
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
US-5767283-A CHEMICAL INTERMEDIATE FOR 7-N-ORGANOSULFONYL-1H-INDOLE DERIVATIVE ANTITUMOR AGENTS; NONTOXIC EISAI CO., LTD. (JP) 1998-06-16 US disclosed
US-5721246-A ANTITUMOR AGENTS; LOW TOXICITY EISAI CO., LTD. (JP) 1998-02-24 US 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 SLC40A1 3795/4885PGR 1305/4885NR3C1 570/4885
US-20100267754-A1 INTEGRIN EXPRESSION INHIBITOR ITGB5, ITGB1, ITGB2 SLC40A1 3795/4885PGR 1305/4885NR3C1 570/4885
US-20040018192-A1 Integrin expression inhibitors ITGB1, ITGB4, ITGB5 SLC40A1 3835/4885PGR 1278/4885NR3C1 614/4885

“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.