SCHEMBL8829381

SCHEMBL8829381

CS(=O)(=O)NC(=O)c1cccc(OC[C@H]2COc3ccc(OCc4nc5cc(F)ccc5s4)cc3[C@H]2O)c1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 8/20 0.66
CYSLTR2 Q9NS75 7/20 0.66
PTGER4 P35408 2/20 0.51
SCN3A Q9NY46 1/20 0.43
LTB4R Q15722 2/20 0.41
ALOX5 P09917 2/20 0.37
SCN9A Q15858 1/20 0.36

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
SCHEMBL8829395 1.00 CYSLTR1 (0.66) CYSLTR1CYSLTR2PTGER4SCN3ALTB4R
SCHEMBL8829376 1.00 CYSLTR1 (0.66) CYSLTR1CYSLTR2PTGER4SCN3ALTB4R
SCHEMBL8829375 0.91 CYSLTR1 (0.80) CYSLTR1CYSLTR2PTGER4LTB4R
SCHEMBL8829409 0.91 CYSLTR1 (0.80) CYSLTR1CYSLTR2PTGER4LTB4R
SCHEMBL8829374 0.91 CYSLTR1 (0.80) CYSLTR1CYSLTR2PTGER4LTB4R
SCHEMBL8829475 0.86 CYSLTR1 (0.69) CYSLTR1CYSLTR2PTGER4LTB4RALOX5
SCHEMBL8829469 0.86 CYSLTR1 (0.69) CYSLTR1CYSLTR2PTGER4LTB4RALOX5
SCHEMBL8829472 0.86 CYSLTR1 (0.69) CYSLTR1CYSLTR2PTGER4LTB4RALOX5
SCHEMBL8829342 0.83 CYSLTR1 (0.79) CYSLTR1CYSLTR2PTGER4LTB4R
SCHEMBL8829347 0.83 CYSLTR1 (0.79) CYSLTR1CYSLTR2PTGER4LTB4R

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