SCHEMBL8733699

SCHEMBL8733699

COC(=O)c1ccc(CC(C)NS(=O)(=O)c2ccc3ccc(OCc4ccc5ccccc5n4)cc3c2)c(OC)c1

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 9/20 0.70
CYSLTR2 Q9NS75 1/20 0.52
ADAMTS4 O75173 1/20 0.49
ALOX5 P09917 1/20 0.45
PDE4A P27815 1/20 0.45
PDE4B Q07343 1/20 0.45
PDE4C Q08493 1/20 0.45
PDE4D Q08499 1/20 0.45
PDE3B Q13370 1/20 0.45
PDE3A Q14432 1/20 0.45

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
SCHEMBL8732779 0.95 CYSLTR1 (0.79) CYSLTR1CYSLTR2ADAMTS4
SCHEMBL8734143 0.88 CYSLTR1 (0.86) CYSLTR1CYSLTR2ADAMTS4
SCHEMBL8733773 0.85 CYSLTR1 (0.80) CYSLTR1ADAMTS4
SCHEMBL8734127 0.83 CYSLTR1 (1.00) CYSLTR1CYSLTR2ADAMTS4
SCHEMBL8734190 0.80 CYSLTR1 (0.81) CYSLTR1CYSLTR2ADAMTS4ALOX5
SCHEMBL8734137 0.80 CYSLTR1 (0.63) CYSLTR1ADAMTS4ALOX5PDE4APDE4B
SCHEMBL8736033 0.80 CYSLTR1 (0.85) CYSLTR1CYSLTR2ADAMTS4
SCHEMBL8736040 0.79 CYSLTR1 (0.60) CYSLTR1CYSLTR2
SCHEMBL7810130 0.79 CYSLTR1 (0.79) CYSLTR1CYSLTR2
SCHEMBL8736498 0.77 CYSLTR1 (0.63) CYSLTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0874826-A1 NAPHTHALENE QUINOLINES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1998-11-04 EP disclosed
WO-1997024331-A1 NAPHTHALENE QUINOLINES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1997-07-10 WO disclosed