SCHEMBL8565146

SCHEMBL8565146

CCc1ccc(O)cc1OCCCCCC(c1ccccc1)c1nnn[nH]1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 10/20 0.39
LTB4R Q15722 4/20 0.38
LTB4R2 Q9NPC1 3/20 0.38
CNR1 P21554 8/20 0.38
NR1H4 Q96RI1 4/20 0.38
CYSLTR2 Q9NS75 1/20 0.35
CYSLTR1 Q9Y271 1/20 0.35

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
SCHEMBL8569026 0.77 NR1H4 (0.44) LTB4RLTB4R2NR1H4
SCHEMBL28763158 0.72 CNR2 (0.43) CNR2LTB4RLTB4R2CNR1NR1H4
SCHEMBL3813663 0.70 TBXAS1 (0.37)
SCHEMBL27694393 0.66 CNR2 (0.46) CNR2CNR1CYSLTR2CYSLTR1
SCHEMBL7819515 0.66 HTR2A (0.39)
SCHEMBL27694394 0.65 CNR2 (0.46) CNR2CNR1CYSLTR2CYSLTR1
SCHEMBL16799916 0.62 MAPT (0.37)
SCHEMBL9698367 0.62 CNR2 (0.62) CNR2CNR1
SCHEMBL29111141 0.61 CNR2 (0.54) CNR2CNR1CYSLTR2CYSLTR1
SCHEMBL27675853 0.61 CNR2 (0.45) CNR2CNR1CYSLTR2CYSLTR1

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