SCHEMBL8941394

SCHEMBL8941394

C=CCc1c(OCCCOc2ccc3c(c2CCC)OC(CCC(=O)O)CC3)ccc(C(N)=O)c1OC

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 19/20 0.69
LTB4R2 Q9NPC1 11/20 0.69
CYSLTR2 Q9NS75 1/20 0.49
CYSLTR1 Q9Y271 1/20 0.49

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
SCHEMBL8941442 0.94 LTB4R (0.76) LTB4RLTB4R2CYSLTR2CYSLTR1
SCHEMBL8941451 0.91 LTB4R (0.84) LTB4RLTB4R2CYSLTR2CYSLTR1
SCHEMBL8941328 0.91 LTB4R (0.83) LTB4RLTB4R2CYSLTR2CYSLTR1
SCHEMBL8941379 0.88 LTB4R (0.87) LTB4RLTB4R2
SCHEMBL5694677 0.86 LTB4R (0.76) LTB4RLTB4R2CYSLTR2CYSLTR1
SCHEMBL9193027 0.86 LTB4R (0.69) LTB4RLTB4R2
SCHEMBL8957284 0.86 LTB4R (0.55) LTB4RLTB4R2CYSLTR2CYSLTR1
SCHEMBL8957064 0.85 LTB4R (0.75) LTB4RLTB4R2
SCHEMBL9197680 0.85 LTB4R (0.74) LTB4RLTB4R2
SCHEMBL8941433 0.84 LTB4R (0.91) LTB4RLTB4R2CYSLTR2CYSLTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5532383-A Leukotriene B4 antagonists G. D. SEARLE & CO. (US) 1996-07-02 US disclosed
US-5516917-A ANTIINFLAMMATORY AGENTS G. D. SEARLE & CO. (US) 1996-05-14 US disclosed
WO-1995033742-A1 LEUKOTRIENE B4 ANTAGONISTS G.D. SEARLE & CO. (US) 1995-12-14 WO disclosed
EP-0593478-B1 LEUKOTRIENE B 4 ANTAGONISTS SEARLE & CO (US) 1995-12-06 EP disclosed
US-5439937-A Leukotriene B4 antagonists G. D. SEARLE & CO. (US) 1995-08-08 US disclosed
US-5310951-A Benzopyran-2-propanoic acid derivatives; antiinflammatory agents G.D. SEARLE & CO. (US) 1994-05-10 US disclosed
EP-0593478-A1 LEUKOTRIENE B 4? ANTAGONISTS. SEARLE & CO (US) 1994-04-27 EP disclosed
US-5124350-A Antiinflammatory agent G. D. SEARLE & CO. (US) 1992-06-23 US disclosed
WO-1992000011-A2 LEUKOTRIENE B4 ANTAGONISTS G.D. SEARLE & CO. (US) 1992-01-09 WO disclosed