SCHEMBL8829482

SCHEMBL8829482

NC(=O)c1cccc(C[C@@H]2COc3ccc(OCc4ccc5ccccc5n4)cc3[C@@H]2O)c1

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 10/20 0.71
CYSLTR1 Q9Y271 4/20 0.57
CYSLTR2 Q9NS75 2/20 0.57
GPBAR1 Q8TDU6 1/20 0.48
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
SCHEMBL8829478 1.00 LTB4R (0.71) LTB4RCYSLTR1CYSLTR2GPBAR1LTB4R2
SCHEMBL8829477 1.00 LTB4R (0.71) LTB4RCYSLTR1CYSLTR2GPBAR1LTB4R2
SCHEMBL8465979 0.94 LTB4R (0.73) LTB4RCYSLTR1CYSLTR2GPBAR1LTB4R2
SCHEMBL8465780 0.94 LTB4R (0.73) LTB4RCYSLTR1CYSLTR2GPBAR1LTB4R2
SCHEMBL8464095 0.94 LTB4R (0.73) LTB4RCYSLTR1CYSLTR2GPBAR1LTB4R2
SCHEMBL8465774 0.94 LTB4R (0.73) LTB4RCYSLTR1CYSLTR2GPBAR1LTB4R2
SCHEMBL8465632 0.94 LTB4R (0.73) LTB4RCYSLTR1CYSLTR2GPBAR1LTB4R2
SCHEMBL8464461 0.91 LTB4R (0.69) LTB4RCYSLTR1CYSLTR2GPBAR1
SCHEMBL8524172 0.91 LTB4R (0.69) LTB4RCYSLTR1CYSLTR2GPBAR1
SCHEMBL8466039 0.91 LTB4R (0.69) LTB4RCYSLTR1CYSLTR2GPBAR1

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-0404440-B1 Substituted sulfonamides and related compounds in the treatment of asthma, arthritis, and related diseases PFIZER (US) 1997-11-05 EP disclosed
US-5384318-A Substituted sulfonamides and related compounds in the treatment of asthma, arthritis and related diseases PFIZER INC. (US) 1995-01-24 US disclosed
WO-1990015801-A1 SUBSTITUTED SULFONAMIDES AND RELATED COMPOUNDS IN THE TREATMENT OF ASTHMA, ARTHRITIS AND RELATED DISEASES PFIZER INC. (US) 1990-12-27 WO disclosed