SCHEMBL8735747

SCHEMBL8735747

CC(=O)Oc1cccc(C)c1C(C)NS(=O)(=O)c1ccc2ccc(OCc3ccc4ccccc4n3)cc2c1

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 8/20 0.65
ADAMTS4 O75173 1/20 0.52
CYSLTR2 Q9NS75 1/20 0.46
GPBAR1 Q8TDU6 1/20 0.46

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
SCHEMBL8736013 0.88 CYSLTR1 (0.64) CYSLTR1ADAMTS4CYSLTR2
SCHEMBL8735750 0.87 CYSLTR1 (0.69) CYSLTR1ADAMTS4CYSLTR2GPBAR1
SCHEMBL8735894 0.79 CYSLTR1 (1.00) CYSLTR1ADAMTS4CYSLTR2
SCHEMBL8736503 0.79 CYSLTR1 (0.77) CYSLTR1ADAMTS4CYSLTR2
SCHEMBL8735635 0.78 CYSLTR1 (0.68) CYSLTR1ADAMTS4
SCHEMBL8732424 0.78 CYSLTR1 (0.86) CYSLTR1ADAMTS4
SCHEMBL8736033 0.75 CYSLTR1 (0.85) CYSLTR1ADAMTS4CYSLTR2
SCHEMBL8734127 0.75 CYSLTR1 (1.00) CYSLTR1ADAMTS4CYSLTR2GPBAR1
SCHEMBL8734190 0.75 CYSLTR1 (0.81) CYSLTR1ADAMTS4CYSLTR2
SCHEMBL8734143 0.75 CYSLTR1 (0.86) CYSLTR1ADAMTS4CYSLTR2

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