SCHEMBL8080183

SCHEMBL8080183

CCc1ccccc1Oc1ccc(CS(=O)(=O)c2c(Cl)cccc2Cl)nc1C=CC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 16/20 0.48
HSD11B1 P28845 1/20 0.38
PLA2G1B P04054 1/20 0.37
MAPT P10636 1/20 0.37
ATG4B Q9Y4P1 1/20 0.37
CXCL8 P10145 1/20 0.37

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
SCHEMBL7021927 0.84 LTB4R (0.66) LTB4R
SCHEMBL8075079 0.83 LTB4R (0.49) LTB4RPLA2G1BMAPTATG4B
SCHEMBL7019214 0.81 LTB4R (0.43) LTB4R
SCHEMBL8080568 0.80 LTB4R (0.44) LTB4RPLA2G1BMAPTATG4BCXCL8
SCHEMBL8080181 0.80 LTB4R (0.72) LTB4R
SCHEMBL8076051 0.80 CXCL8 (0.40) LTB4RHSD11B1CXCL8
SCHEMBL7022921 0.76 LTB4R (0.55) LTB4RCXCL8
SCHEMBL7030563 0.73 LTB4R (0.54) LTB4R
SCHEMBL7019517 0.71 LMNA (0.37) LTB4RMAPT
SCHEMBL7018873 0.69 PAM (0.38) LTB4RCXCL8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0733044-A4 COMPOUNDS SMITHKLINE BEECHAM CORP (US) 1997-03-05 EP claimed
EP-0733044-A1 COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1996-09-25 EP claimed
WO-1995015950-A1 COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1995-06-15 WO claimed
EP-0812194-B1 Use of substituted pyridine compounds for treating atopic dermatitis and contact dermatitis SMITHKLINE BEECHAM CORP (US) 2000-08-16 EP disclosed
US-5990314-A LEUKOTRIENE ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-11-23 US disclosed
EP-0812194-A4 METHOD FOR TREATING ATOPIC DERMATITIS AND CONTACT DERMATITIS SMITHKLINE BEECHAM CORP (US) 1998-03-11 EP disclosed
EP-0812194-A1 METHOD FOR TREATING ATOPIC DERMATITIS AND CONTACT DERMATITIS SMITHKLINE BEECHAM CORPORATION (US) 1997-12-17 EP disclosed
EP-0733044-A4 COMPOUNDS SMITHKLINE BEECHAM CORP (US) 1997-03-05 EP disclosed
EP-0733044-A1 COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1996-09-25 EP disclosed
WO-1996026725-A1 METHOD FOR TREATING ATOPIC DERMATITIS AND CONTACT DERMATITIS SMITHKLINE BEECHAM CORPORATION (US) 1996-09-06 WO disclosed
WO-1995015950-A1 COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1995-06-15 WO disclosed