SCHEMBL9524451

SCHEMBL9524451

COc1ccc(CCN(C)C(=O)Cn2cc(C=CC(=O)O)c3cc(OCc4ccccc4)ccc32)cc1

nearest known ligand 0.92

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 20/20 0.92
LTB4R2 Q9NPC1 19/20 0.92

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
SCHEMBL6759616 0.96 LTB4R (1.00) LTB4RLTB4R2
SCHEMBL6759618 0.96 LTB4R (1.00) LTB4RLTB4R2
SCHEMBL9023529 0.93 LTB4R (0.92) LTB4RLTB4R2
SCHEMBL9023527 0.93 LTB4R (0.92) LTB4RLTB4R2
SCHEMBL9524838 0.92 LTB4R (0.78) LTB4RLTB4R2
SCHEMBL9023084 0.91 LTB4R (0.91) LTB4RLTB4R2
SCHEMBL9023289 0.91 LTB4R (1.00) LTB4RLTB4R2
SCHEMBL9023284 0.91 LTB4R (1.00) LTB4RLTB4R2
SCHEMBL9023713 0.90 LTB4R (0.85) LTB4RLTB4R2
SCHEMBL9141658 0.90 LTB4R (0.85) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0548250-A4 SUBSTITUTED BICYCLIC ARYL COMPOUNDS EXHIBITING SELECTIVE LEUKOTRIENE B 4? ANTAGONIST ACTIVITY 1993-10-27 EP disclosed
EP-0548250-A1 SUBSTITUTED BICYCLIC ARYL COMPOUNDS EXHIBITING SELECTIVE LEUKOTRIENE B 4? ANTAGONIST ACTIVITY. RHONE POULENC RORER INT (US) 1993-06-30 EP disclosed
WO-1992004321-A1 SUBSTITUTED BICYCLIC ARYL COMPOUNDS EXHIBITING SELECTIVE LEUKOTRIENE B4 ANTAGONIST ACTIVITY RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1992-03-19 WO disclosed