SCHEMBL7801642

SCHEMBL7801642

O=C(O)c1ccc2ccc(OCc3ccc4ccccc4n3)cc2c1

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 3/20 0.81
CYSLTR1 Q9Y271 8/20 0.79

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
SCHEMBL7801672 0.97 GPBAR1 (0.85) GPBAR1CYSLTR1
SCHEMBL8736537 0.93 CYSLTR1 (0.82) GPBAR1CYSLTR1
SCHEMBL421067 0.89 GPBAR1 (1.00) GPBAR1CYSLTR1
SCHEMBL8735687 0.89 GPBAR1 (0.74) GPBAR1CYSLTR1
SCHEMBL8734219 0.89 CYSLTR1 (1.00) GPBAR1CYSLTR1
SCHEMBL9581634 0.88 GPBAR1 (0.97) GPBAR1CYSLTR1
SCHEMBL9581618 0.88 GPBAR1 (0.97) GPBAR1CYSLTR1
SCHEMBL7810130 0.88 CYSLTR1 (0.79) GPBAR1CYSLTR1
SCHEMBL8736480 0.88 CYSLTR1 (0.96) GPBAR1CYSLTR1
SCHEMBL422355 0.87 CYSLTR1 (1.00) GPBAR1CYSLTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0775133-B1 NAPHTHALENE AMIDES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION MENARINI LAB (ES) 2001-05-30 EP disclosed
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
EP-0775133-A1 NAPHTHALENE AMIDES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1997-05-28 EP disclosed
WO-1996004267-A1 NAPHTHALENE AMIDES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1996-02-15 WO disclosed