SCHEMBL7801976

SCHEMBL7801976

CCC(NC(=O)c1ccc2ccc(OCc3ccc4ccccc4n3)cc2c1)c1ccc(-c2nnn[nH]2)cc1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 7/20 0.52
ALOX5 P09917 1/20 0.47
PDE4A P27815 1/20 0.47
PDE4B Q07343 1/20 0.47
PDE4C Q08493 1/20 0.47
PDE4D Q08499 1/20 0.47
PDE3B Q13370 1/20 0.47
PDE3A Q14432 1/20 0.47

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
SCHEMBL7810015 0.91 CYSLTR1 (0.54) CYSLTR1ALOX5PDE4APDE4BPDE4C
SCHEMBL7808452 0.83 CYSLTR1 (0.64) CYSLTR1
SCHEMBL7808360 0.82 CYSLTR1 (0.76) CYSLTR1
SCHEMBL7801971 0.81 CYSLTR1 (0.69) CYSLTR1
SCHEMBL7808321 0.77 CYSLTR1 (0.56) CYSLTR1
SCHEMBL7809966 0.77 CYSLTR1 (0.75) CYSLTR1ALOX5PDE4APDE4BPDE4C
SCHEMBL12892171 0.76 CYSLTR1 (0.59) CYSLTR1
SCHEMBL9033033 0.75 GPBAR1 (0.54) CYSLTR1
SCHEMBL7717086 0.74 CYSLTR1 (0.56) CYSLTR1ALOX5
SCHEMBL8734229 0.74 CYSLTR1 (0.60) 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 4 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 claimed
WO-1996004267-A1 NAPHTHALENE AMIDES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1996-02-15 WO claimed
EP-0775133-B1 NAPHTHALENE AMIDES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION MENARINI LAB (ES) 2001-05-30 EP disclosed
WO-1996004267-A1 NAPHTHALENE AMIDES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1996-02-15 WO disclosed