SCHEMBL7500207

SCHEMBL7500207

NC(=O)N(c1ccccc1Br)c1ccc(Cl)c(S(=O)(=O)NC2CCCC2)c1O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
ALDH1A1 P00352 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TP53 P04637 2/20 0.38
LMNA P02545 1/20 0.38
CXCR2 P25025 4/20 0.38
CXCR1 P25024 2/20 0.38
HTT P42858 2/20 0.37
MAPK1 P28482 1/20 0.37
PKM P14618 1/20 0.36
ALOX15 P16050 1/20 0.36
GRM4 Q14833 1/20 0.35
EPHX2 P34913 1/20 0.35
HSP90AA1 P07900 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35
CCR6 P51684 2/20 0.35

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
SCHEMBL6550852 0.83 CXCR2 (0.41) CXCR2CXCR1
SCHEMBL27608152 0.81 CXCR2 (0.51) CXCR2CXCR1
SCHEMBL27571760 0.79 CXCR2 (0.45) ALDH1A1CXCR2CXCR1HTTMAPK1
SCHEMBL27552112 0.76 CASP3 (0.37) ALDH1A1L3MBTL1CXCR2CXCR1KMT2A
SCHEMBL27552241 0.76 PLAU (0.39) CXCR2CXCR1
SCHEMBL7542421 0.76 CXCR2 (0.39) LMNACXCR2CXCR1HTT
SCHEMBL7500837 0.75 LMNA (0.37) ALDH1A1LMNACXCR2CXCR1PKM
SCHEMBL7688982 0.75 PKM (0.42) MAPTALDH1A1TP53LMNACXCR2
SCHEMBL7664526 0.74 CXCR2 (0.39) MAPTALDH1A1CXCR2CXCR1MAPK1
SCHEMBL7666870 0.74 CXCR1 (0.39) CXCR2CXCR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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