SCHEMBL8889605

SCHEMBL8889605

O=S(=O)(Nc1cccc(CC2COc3ccc(O)cc3C2O)c1)C(F)(F)F

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 15/20 0.54
LTB4R2 Q9NPC1 12/20 0.54
CYSLTR2 Q9NS75 2/20 0.42
CYSLTR1 Q9Y271 2/20 0.42

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
SCHEMBL8890711 0.82 LTB4R (0.40) LTB4RLTB4R2CYSLTR2CYSLTR1
SCHEMBL8890710 0.82 LTB4R (0.40) LTB4RLTB4R2CYSLTR2CYSLTR1
SCHEMBL8888725 0.80 LTB4R (0.66) LTB4RLTB4R2CYSLTR2CYSLTR1
SCHEMBL9220544 0.80 LTB4R (0.66) LTB4RLTB4R2CYSLTR2CYSLTR1
SCHEMBL8888733 0.80 LTB4R (0.66) LTB4RLTB4R2CYSLTR2CYSLTR1
SCHEMBL8900137 0.80 MAOB (0.43) LTB4RLTB4R2CYSLTR2CYSLTR1
SCHEMBL8889488 0.78 LTB4R (0.55) LTB4RLTB4R2CYSLTR2CYSLTR1
SCHEMBL9209746 0.78 LTB4R (0.52) LTB4RLTB4R2CYSLTR2CYSLTR1
SCHEMBL9212064 0.78 LTB4R (0.55) LTB4RLTB4R2CYSLTR2CYSLTR1
SCHEMBL8889593 0.78 LTB4R (0.55) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5641789-A INHIBITORS OF LEUKOTRIENES AND/OR BLOCKERS OF LEUKOTRIENE RECEPTORS; USEFUL IN PREVENTION OR TREATMENT OF ASTHMA, ARTHRITIS, PSORIASIS, ULCERS, MYOCARDIAL INFARCTION PFIZER INC. (US) 1997-06-24 US disclosed