SCHEMBL6823930

SCHEMBL6823930

O=C(Nc1ccccc1Br)Nc1ccc(Cl)c(Cl)c1O.O=C(Nc1ccccc1Br)Nc1ccc(Cl)c(Cl)c1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 15/20 1.00
CXCR1 P25024 11/20 1.00
HTT P42858 3/20 0.55
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
NPC1 O15118 1/20 0.55
LMNA P02545 1/20 0.55
RAB9A P51151 1/20 0.55
CX3CR1 P49238 1/20 0.54
GRIK1 P39086 1/20 0.51
TDP1 Q9NUW8 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
CASP3 P42574 1/20 0.49
SENP8 Q96LD8 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
SENP6 Q9GZR1 1/20 0.49

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
SCHEMBL3716985 1.00 CXCR2 (1.00) CXCR2CXCR1HTTMEN1KMT2A
SCHEMBL7492139 0.88 CXCR2 (0.77) CXCR2CXCR1CX3CR1GAA
SCHEMBL6823110 0.87 CXCR2 (0.75) CXCR2CXCR1MEN1KMT2ANPC1
SCHEMBL6822942 0.84 CXCR2 (0.73) CXCR2CXCR1HTTMEN1KMT2A
SCHEMBL3706591 0.84 CXCR2 (0.73) CXCR2CXCR1HTTMEN1KMT2A
SCHEMBL6550734 0.83 CXCR2 (1.00) CXCR2CXCR1HTTMEN1KMT2A
SCHEMBL1880282 0.83 CXCR2 (0.70) CXCR2CXCR1MEN1KMT2ALMNA
SCHEMBL7487837 0.82 CXCR2 (1.00) CXCR2CXCR1HTTMEN1KMT2A
SCHEMBL6550665 0.82 CXCR2 (1.00) CXCR2CXCR1HTTMEN1KMT2A
SCHEMBL7553831 0.82 CXCR2 (1.00) CXCR2CXCR1HTTMEN1KMT2A

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-1185261-A4 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2004-02-25 EP disclosed
EP-1185261-A1 IL-8 RECEPTOR ANTAGONISTS SmithKline Beecham Corporation (US) 2002-03-13 EP disclosed
WO-2000076495-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2000-12-21 WO disclosed