SCHEMBL8569884

SCHEMBL8569884

CCOC(=O)CCc1c(O)cccc1OCCCCC(=O)OC

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 8/20 0.54
CNR1 P21554 7/20 0.54
PPARG P37231 2/20 0.46
LTB4R Q15722 2/20 0.42
LTB4R2 Q9NPC1 2/20 0.42
CYP4F2 P78329 1/20 0.42
CYP4A11 Q02928 1/20 0.42
PPARA Q07869 1/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA7 P43166 1/20 0.40
CA14 Q9ULX7 1/20 0.40
DHFR P00374 1/20 0.40

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
SCHEMBL8566189 0.95 CNR1 (0.56) CNR2CNR1LTB4RLTB4R2CYP4F2
SCHEMBL27545958 0.88 CNR1 (0.62) CNR2CNR1PPARGLTB4RLTB4R2
SCHEMBL27545957 0.88 CNR1 (0.56) CNR2CNR1LTB4RLTB4R2CYP4F2
SCHEMBL9119385 0.87 CNR2 (0.48) CNR2CNR1PPARGLTB4RLTB4R2
SCHEMBL8567849 0.87 CNR1 (0.51) CNR2CNR1LTB4RLTB4R2CYP4F2
SCHEMBL27573118 0.86 CNR1 (0.64) CNR2CNR1PPARGLTB4RLTB4R2
SCHEMBL27507369 0.86 CNR1 (0.47) CNR2CNR1LTB4RLTB4R2CYP4F2
SCHEMBL6755950 0.84 CNR1 (0.57) CNR2CNR1PPARGLTB4RLTB4R2
SCHEMBL8563285 0.84 CNR1 (0.47) CNR2CNR1LTB4RLTB4R2CYP4F2
SCHEMBL8799756 0.83 PPARG (0.44) CNR2CNR1PPARGLTB4RLTB4R2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0544488-B1 Substituted phenyl phenol leukotriene antagonists LILLY CO ELI (US) 1998-03-11 EP disclosed
CN-1035001-C Substituted phenyl phenol leukotriene antagonists LILLY CO ELI (US) 1997-05-28 CN disclosed
WO-1996036347-A1 USE OF LEUKOTRIENE ANTAGONISTS FOR ALZHEIMER'S DISEASE ELI LILLY AND COMPANY (US) 1996-11-21 WO disclosed
EP-0743064-A1 Leukotriene antagonists for use in the treatment or prevention of alzheimer's disease ELI LILLY AND COMPANY (US) 1996-11-20 EP disclosed
US-5462954-A Antiinflammatory, antiallergens; treating asthma ELI LILLY AND COMPANY (US) 1995-10-31 US disclosed
EP-0544488-A2 Substituted phenyl phenol leukotriene antagonists ELI LILLY AND COMPANY (US) 1993-06-02 EP disclosed