SCHEMBL7863798

SCHEMBL7863798

N#Cc1c(Cl)ccc(NC(=O)NCc2ccccc2)c1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR1 P25024 1/20 0.62
CXCR2 P25025 1/20 0.62
CFD P00746 1/20 0.49
CA12 O43570 3/20 0.48
CA9 Q16790 3/20 0.48
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
KDM4E B2RXH2 4/20 0.48
GSK3B P49841 1/20 0.48
ALDH1A1 P00352 4/20 0.45
POLB P06746 2/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
MAPK1 P28482 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TRPV1 Q8NER1 1/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
HTT P42858 1/20 0.43

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
SCHEMBL5604191 0.83 CXCR1 (0.58) CXCR1CXCR2CFDCA12CA9
SCHEMBL4345948 0.79 KDM4E (0.62) CFDCA12CA9CA1CA2
SCHEMBL7853783 0.78 CXCR2 (0.67) CXCR1CXCR2CFDCA12CA9
SCHEMBL7487837 0.77 CXCR2 (1.00) CXCR1CXCR2KDM4EALDH1A1LMNA
SCHEMBL6129953 0.77 CXCR2 (0.65) CXCR1CXCR2CFDCA12CA9
SCHEMBL27942165 0.75 CFD (0.67) CFDCA12CA9CA1CA2
SCHEMBL4353325 0.74 CA12 (0.55) CFDCA12CA9CA1CA2
SCHEMBL10771005 0.72 ALDH1A1 (0.51) CFDKDM4EGSK3BALDH1A1POLB
SCHEMBL4350061 0.72 MTOR (0.55) CA12CA9CA1CA2GSK3B
SCHEMBL4343441 0.71 CA12 (0.52) CFDCA12CA9CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0915651-A4 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2001-10-24 EP disclosed
US-6271261-B1 CHEMOKINE MEDIATED DISEASES, BINDING INTERLEUKINS OR BETA-RECEPTORS AND ADMINISTERING TO MAMMALS SMITHKLINE BEECHAM CORPORATION 2001-08-07 US disclosed
EP-0915651-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-05-19 EP disclosed
WO-1997049286-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-12-31 WO disclosed