SCHEMBL7808534

SCHEMBL7808534

CCOC(=O)CCCc1ccc(C=O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4Z1 Q86W10 3/20 0.60
CYP4F11 Q9HBI6 1/20 0.60
CYP4F12 Q9HCS2 1/20 0.60
CYP4F2 P78329 2/20 0.57
CYP4A11 Q02928 2/20 0.57
ALOX5 P09917 1/20 0.55
MAPK1 P28482 2/20 0.51
GAA P10253 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
KMT2A Q03164 1/20 0.50
FAAH O00519 1/20 0.46
LTA4H P09960 3/20 0.46
CYP1A2 P05177 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
NR1I2 O75469 1/20 0.44

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
SCHEMBL349384 0.90 CYP4F2 (0.70) CYP4Z1CYP4F11CYP4F12CYP4F2CYP4A11
SCHEMBL765847 0.85 CYP4F2 (0.62) CYP4Z1CYP4F11CYP4F12CYP4F2CYP4A11
SCHEMBL765000 0.85 CYP4F2 (0.62) CYP4Z1CYP4F11CYP4F12CYP4F2CYP4A11
SCHEMBL10289874 0.85 CYP4F2 (0.62) CYP4Z1CYP4F11CYP4F12CYP4F2CYP4A11
SCHEMBL5545806 0.83 CYP4F2 (0.60) CYP4Z1CYP4F11CYP4F12CYP4F2CYP4A11
SCHEMBL22334798 0.83 CYP4F2 (0.65) CYP4Z1CYP4F11CYP4F12CYP4F2CYP4A11
SCHEMBL5050631 0.83 CYP4F2 (0.60) CYP4Z1CYP4F11CYP4F12CYP4F2CYP4A11
SCHEMBL9671800 0.83 CYP4Z1 (0.65) CYP4Z1CYP4F11CYP4F12CYP4F2CYP4A11
SCHEMBL23959915 0.82 CYP4F2 (0.58) CYP4Z1CYP4F11CYP4F12CYP4F2CYP4A11
SCHEMBL10463522 0.82 CYP1A2 (0.59) CYP4Z1CYP4F11CYP4F12CYP4F2CYP4A11

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 3 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-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