SCHEMBL8799511

SCHEMBL8799511

COC(=O)CCCOC(Cc1ccccc1CCCCCCOc1cc(-c2ccccc2)cc(-c2cccs2)n1)C(=O)OC

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 20/20 0.55
LTB4R2 Q9NPC1 1/20 0.46

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
SCHEMBL8800121 0.91 LTB4R (0.55) LTB4RLTB4R2
SCHEMBL9120380 0.85 LTB4R (0.55) LTB4RLTB4R2
SCHEMBL8798911 0.83 LTB4R (0.67) LTB4RLTB4R2
SCHEMBL8799499 0.82 LTB4R (0.67) LTB4RLTB4R2
SCHEMBL9117365 0.81 LTB4R (0.72) LTB4RLTB4R2
SCHEMBL8799534 0.79 LTB4R (0.67) LTB4RLTB4R2
SCHEMBL8987119 0.78 LTB4R (0.64) LTB4R
SCHEMBL8987231 0.75 LTB4R (0.74) LTB4R
SCHEMBL8799218 0.75 LTB4R (0.81) LTB4RLTB4R2
SCHEMBL8466647 0.74 CYP4F2 (0.37) LTB4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0755381-A1 SUBSTITUTED PYRIDINE LEUKOTRIENE B 4 ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 1997-01-29 EP disclosed