SCHEMBL8650764

SCHEMBL8650764

CCCc1c(OCCCOc2cc(O)c(OC)cc2CC)ccc2c1OC(C(=O)O)CC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 20/20 1.00
LTB4R2 Q9NPC1 10/20 0.87

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
SCHEMBL6370354 0.93 LTB4R (1.00) LTB4RLTB4R2
SCHEMBL6378090 0.89 LTB4R (1.00) LTB4RLTB4R2
SCHEMBL6373356 0.88 LTB4R (0.98) LTB4RLTB4R2
SCHEMBL7625803 0.88 LTB4R (1.00) LTB4RLTB4R2
SCHEMBL8650767 0.88 LTB4R (0.79) LTB4RLTB4R2
SCHEMBL3679470 0.86 LTB4R (1.00) LTB4RLTB4R2
SCHEMBL6371833 0.84 LTB4R (0.76) LTB4RLTB4R2
SCHEMBL10342885 0.83 LTB4R (0.75) LTB4RLTB4R2
SCHEMBL8661184 0.82 LTB4R (0.75) LTB4RLTB4R2
SCHEMBL9821842 0.82 LTB4R (0.74) LTB4RLTB4R2

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-0579412-B1 1,2,4-trioxygenated benzene derivatives useful as a leukotriene antagonists LILLY CO ELI (US) 1998-10-07 EP claimed
US-5352690-A For asthma, allergies ELI LILLY AND COMPANY (US) 1994-10-04 US claimed
EP-0579412-A1 1,2,4-trioxygenated benzene derivatives useful as a leukotriene antagonists ELI LILLY AND COMPANY (US) 1994-01-19 EP claimed
EP-0579412-B1 1,2,4-trioxygenated benzene derivatives useful as a leukotriene antagonists LILLY CO ELI (US) 1998-10-07 EP disclosed
US-5352690-A For asthma, allergies ELI LILLY AND COMPANY (US) 1994-10-04 US disclosed
EP-0579412-A1 1,2,4-trioxygenated benzene derivatives useful as a leukotriene antagonists ELI LILLY AND COMPANY (US) 1994-01-19 EP disclosed