SCHEMBL6563444

SCHEMBL6563444

CC(=O)c1c([N+](=O)[O-])ccc(Cl)c1S(=O)(=O)NCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VCAM1 P19320 2/20 0.59
LMNA P02545 3/20 0.47
SLC12A2 P55011 2/20 0.47
SLC12A5 Q9H2X9 2/20 0.47
GAA P10253 2/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
GLA P06280 1/20 0.46
CYP19A1 P11511 2/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
CA12 O43570 2/20 0.41
CA9 Q16790 2/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GSR P00390 1/20 0.40

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
SCHEMBL6563456 0.83 VCAM1 (0.64) VCAM1LMNASLC12A2SLC12A5GAA
SCHEMBL6562309 0.81 ALDH1A1 (0.43) VCAM1LMNAGAAALDH1A1MAPT
SCHEMBL6562243 0.81 VCAM1 (0.41) VCAM1ALDH1A1MAPTMEN1KMT2A
SCHEMBL6550610 0.80 VCAM1 (0.54) VCAM1GAAALDH1A1MAPTKMT2A
SCHEMBL27453481 0.79 VCAM1 (0.64) VCAM1LMNASLC12A2SLC12A5GAA
SCHEMBL6549653 0.75 VCAM1 (0.49) VCAM1GAAALDH1A1MAPTKMT2A
SCHEMBL4504076 0.69 CYP19A1 (0.83) VCAM1LMNASLC12A2SLC12A5GAA
SCHEMBL2450842 0.68 TDP1 (0.58) VCAM1LMNAALDH1A1MAPTKMT2A
SCHEMBL6565699 0.68 VCAM1 (0.45) VCAM1LMNAALDH1A1MAPTCYP19A1
SCHEMBL6564278 0.68 VCAM1 (0.60) VCAM1ALDH1A1MAPTMEN1KMT2A

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 VCAM1 702/4885LMNA 4741/4885SLC12A2 983/4885

“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.