SCHEMBL7027871

SCHEMBL7027871

COc1ccc(CCCCOc2ccc(CSCc3c(Cl)cccc3Cl)nc2/C=C/C(=O)O)cc1

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 20/20 0.80

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
SCHEMBL7027874 1.00 LTB4R (0.80) LTB4R
SCHEMBL8075475 0.91 LTB4R (0.82) LTB4R
SCHEMBL8075479 0.91 LTB4R (0.82) LTB4R
SCHEMBL7019094 0.89 LTB4R (1.00) LTB4R
SCHEMBL7019099 0.89 LTB4R (1.00) LTB4R
SCHEMBL8734195 0.89 LTB4R (0.85) LTB4R
SCHEMBL7022316 0.88 LTB4R (0.98) LTB4R
SCHEMBL7022308 0.88 LTB4R (0.98) LTB4R
SCHEMBL8862112 0.87 LTB4R (0.83) LTB4R
SCHEMBL8862114 0.87 LTB4R (0.83) LTB4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0649412-B1 PHARMACEUTICAL PYRIDINE COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2003-01-15 EP disclosed
US-5643914-A Pharmaceutical pyridine compounds SMITHKLINE BEECHAM CORPORATION (US) 1997-07-01 US 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
EP-0649412-A4 PHARMACEUTICAL PYRIDINE COMPOUNDS. SMITHKLINE BEECHAM CORP (US) 1995-07-05 EP disclosed
WO-1995015950-A1 COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1995-06-15 WO disclosed
EP-0649412-A1 PHARMACEUTICAL PYRIDINE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1995-04-26 EP disclosed
WO-1994000437-A1 PHARMACEUTICAL PYRIDINE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1994-01-06 WO disclosed