SCHEMBL5229701

SCHEMBL5229701

Brc1cccc(Br)c1-c1cccs1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.46
KDM4E B2RXH2 4/20 0.46
TDP1 Q9NUW8 3/20 0.46
MEN1 O00255 2/20 0.46
HPGD P15428 2/20 0.46
KMT2A Q03164 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
ALDH1A1 P00352 2/20 0.46
LTA4H P09960 2/20 0.42
RAB9A P51151 2/20 0.40
PPARG P37231 1/20 0.40
NCOA2 Q15596 1/20 0.40
NCOA1 Q15788 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
NCOA3 Q9Y6Q9 1/20 0.40
TYMP P19971 1/20 0.39
DPP4 P27487 1/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C9 P11712 2/20 0.38

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
SCHEMBL28996624 0.88 MAPT (0.43) MAPTKDM4ETDP1MEN1HPGD
SCHEMBL1334679 0.87 LTK (0.41) MAPTKDM4ETDP1MEN1HPGD
SCHEMBL29403545 0.81 ALDH1A1 (0.48) MAPTKDM4ETDP1MEN1HPGD
SCHEMBL7135870 0.79 MAPT (0.52) MAPTKDM4ETDP1MEN1HPGD
SCHEMBL2964652 0.76 KDM4E (0.35) MAPTKDM4ETDP1MEN1HPGD
SCHEMBL1310723 0.74 LTA4H (0.47) MAPTKDM4ETDP1MEN1HPGD
SCHEMBL30966574 0.74 LTA4H (0.47) MAPTKDM4ETDP1MEN1HPGD
SCHEMBL7450150 0.73 KDM4E (0.48) MAPTKDM4ETDP1MEN1HPGD
SCHEMBL3545 0.73 L3MBTL1 (0.57) MAPTKDM4ETDP1MEN1HPGD
SCHEMBL16291133 0.73 L3MBTL1 (0.57) MAPTKDM4ETDP1MEN1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1261336-B1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2007-02-07 EP disclosed
EP-1261336-A4 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2004-12-15 EP disclosed
EP-1161232-B1 HYDROXY DIPHENYL UREA SULFONAMIDES AS IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2004-03-24 EP disclosed
US-6608077-B2 Sulfonamide substituted diphenyl urea derivatives; treating chemokine mediated disease SMITHKLINE BEECHAM CORPORATION 2003-08-19 US disclosed
US-20030109527-A1 Hydroxy diphenyl urea sulfonamides as IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION 2003-06-12 US disclosed
US-20030055286-A1 Sulfonamide substituted diphenyl urea derivatives; treating chemokine mediated disease SMITHKLINE BEECHAM CORPORATION 2003-03-20 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-1261336-A2 IL-8 RECEPTOR ANTAGONISTS SmithKline Beecham Corporation (US) 2002-12-04 EP 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-2001068568-A2 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2001-09-20 WO 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 (2 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-20030055286-A1 Sulfonamide substituted diphenyl urea derivatives; treating chemokine mediated disease CXCL8, CCR8, CCL2 MAPT 2058/4885KDM4E 3956/4885TDP1 2387/4885
US-20030109527-A1 Hydroxy diphenyl urea sulfonamides as IL-8 receptor antagonists CXCL8, CCR8, IL18 MAPT 3345/4885KDM4E 4081/4885TDP1 3864/4885

“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.