SCHEMBL8568097

SCHEMBL8568097

CCc1cc(-c2cccc(F)c2)c(OCc2ccccc2)cc1OCCCCCC(C)(C)C#N

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 14/20 0.49
LTB4R2 Q9NPC1 13/20 0.49
NR1H4 Q96RI1 4/20 0.47
C5AR1 P21730 1/20 0.41

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
SCHEMBL8568257 0.92 NR1H4 (0.52) LTB4RLTB4R2NR1H4
SCHEMBL6758945 0.91 NR1H4 (0.49) LTB4RLTB4R2NR1H4
SCHEMBL6757622 0.91 NR1H4 (0.51) LTB4RLTB4R2NR1H4
SCHEMBL8563594 0.90 LTB4R (0.48) LTB4RLTB4R2NR1H4
SCHEMBL6759116 0.90 NR1H4 (0.47) LTB4RLTB4R2NR1H4
SCHEMBL8562583 0.90 LTB4R (0.50) LTB4RLTB4R2NR1H4
SCHEMBL8563668 0.89 LTB4R (0.49) LTB4RLTB4R2NR1H4C5AR1
SCHEMBL8563809 0.88 NR1H4 (0.46) LTB4RLTB4R2NR1H4
SCHEMBL8563732 0.86 NR1H4 (0.49) LTB4RLTB4R2NR1H4
SCHEMBL8563657 0.85 NR1H4 (0.49) LTB4RLTB4R2NR1H4C5AR1

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-0544488-B1 Substituted phenyl phenol leukotriene antagonists LILLY CO ELI (US) 1998-03-11 EP 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