SCHEMBL9023563

SCHEMBL9023563

CN(CCc1ccccc1)C(=O)COc1ccc2c(c1)c(C=CC(=O)O)cn2Cc1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 18/20 0.76
LTB4R2 Q9NPC1 17/20 0.76
NPC1 O15118 1/20 0.46
RAB9A P51151 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
SCHEMBL9022958 0.94 LTB4R (0.87) LTB4RLTB4R2
SCHEMBL9023288 0.91 LTB4R (0.64) LTB4RLTB4R2
SCHEMBL9023552 0.91 LTB4R (0.74) LTB4RLTB4R2
SCHEMBL6759618 0.86 LTB4R (1.00) LTB4RLTB4R2
SCHEMBL6759616 0.86 LTB4R (1.00) LTB4RLTB4R2
SCHEMBL9023315 0.85 LTB4R (0.73) LTB4RLTB4R2
SCHEMBL9022980 0.84 LTB4R (0.82) LTB4RLTB4R2
SCHEMBL9022981 0.84 LTB4R (0.82) LTB4RLTB4R2
SCHEMBL9023529 0.83 LTB4R (0.92) LTB4RLTB4R2
SCHEMBL9524451 0.83 LTB4R (0.92) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0548250-B1 SUBSTITUTED BICYCLIC ARYL COMPOUNDS EXHIBITING SELECTIVE LEUKOTRIENE B4 ANTAGONIST ACTIVITY RHONE POULENC RORER INT (US) 1996-03-27 EP disclosed
US-5468898-A Substituted naphthylene compounds exhibiting selective leukotriene B4 antagonist activity RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1995-11-21 US disclosed
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