SCHEMBL6562084

SCHEMBL6562084

Nc1c(N2CCCC2)cc(Cl)c(S(N)(=O)=O)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.44
MAPT P10636 6/20 0.44
L3MBTL1 Q9Y468 4/20 0.44
POLB P06746 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 2/20 0.44
APAF1 O14727 1/20 0.44
TP53 P04637 1/20 0.44
THRB P10828 1/20 0.44
TSHR P16473 1/20 0.44
CASP1 P29466 1/20 0.44
CASP3 P42574 1/20 0.44
RECQL P46063 1/20 0.44
BLM P54132 1/20 0.44
CASP7 P55210 1/20 0.44
SMAD3 P84022 1/20 0.44
SENP8 Q96LD8 1/20 0.44
HSD17B10 Q99714 1/20 0.44
SENP7 Q9BQF6 1/20 0.44

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
SCHEMBL6564153 0.80 ALDH1A1 (0.46) ALDH1A1MAPTL3MBTL1POLBMEN1
SCHEMBL6563415 0.80 CA1 (0.32) CA1CA2CA9CA12CA7
SCHEMBL11148223 0.71 ALDH1A1 (0.48) ALDH1A1MAPTL3MBTL1POLBMEN1
SCHEMBL6563575 0.71 KDM4E (0.35) MAPTL3MBTL1POLBMEN1KMT2A
SCHEMBL6562116 0.70 ALDH1A1 (0.48) ALDH1A1MAPTL3MBTL1POLBMEN1
SCHEMBL23850842 0.63 ALDH1A1 (0.59) ALDH1A1MAPTL3MBTL1POLBMEN1
SCHEMBL29669393 0.63 ALDH1A1 (0.50) ALDH1A1MAPTL3MBTL1POLBMEN1
SCHEMBL23851388 0.63 ALDH1A1 (0.49) ALDH1A1MAPTL3MBTL1POLBMEN1
SCHEMBL4604015 0.62 CXCR2 (0.47) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL31587945 0.62 ALDH1A1 (0.53) ALDH1A1MAPTL3MBTL1POLBMEN1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1161232-B1 HYDROXY DIPHENYL UREA SULFONAMIDES AS IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2004-03-24 EP disclosed
US-20030109527-A1 Hydroxy diphenyl urea sulfonamides as IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION 2003-06-12 US disclosed
US-6500863-B1 INTERLEUKIN BINDING INHIBITORS SUCH AS N-(2-HYDROXYL-3-AMINO SULFONYL-4-CHLOROPHENYL)-N'-(2-BROMOPHENYL)UREA, USED FOR PROPHYLAXIS OF CHEMOKINE MEDIATED DISEASES SMITHKLINE BEECHAM CORPORATION 2002-12-31 US disclosed
EP-1161232-A4 HYDROXY DIPHENYL UREA SULFONAMIDES AS IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2002-09-18 EP disclosed
EP-1161232-A1 HYDROXY DIPHENYL UREA SULFONAMIDES AS IL-8 RECEPTOR ANTAGONISTS SmithKline Beecham Corporation (US) 2001-12-12 EP disclosed
WO-2000035442-A1 HYDROXY DIPHENYL UREA SULFONAMIDES AS IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2000-06-22 WO 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 (1 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-20030109527-A1 Hydroxy diphenyl urea sulfonamides as IL-8 receptor antagonists CXCL8, CCR8, IL18 ALDH1A1 1321/4885MAPT 3345/4885L3MBTL1 4093/4885

“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.