SCHEMBL27485652

SCHEMBL27485652

Nc1ccc(-c2cc(C(=O)O)nn2-c2ccc(S(N)(=O)=O)cc2)cc1

nearest known ligand 0.80

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 6/20 0.65
PTGS1 P23219 3/20 0.65
RPA1 P27694 2/20 0.65
CHRNA7 P36544 6/20 0.64
ALOX5 P09917 2/20 0.61
SMN1; SMN2 Q16637 2/20 0.60
CA9 Q16790 3/20 0.59

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
SCHEMBL5236666 0.90 RPA1 (0.72) PTGS2PTGS1RPA1ALOX5CA9
SCHEMBL3873219 0.89 CHRNA7 (0.80) PTGS2RPA1CHRNA7SMN1; SMN2
SCHEMBL27485627 0.89 PTGS2 (0.69) PTGS2PTGS1RPA1CHRNA7ALOX5
SCHEMBL5430032 0.89 CA9 (0.74) PTGS2PTGS1RPA1CHRNA7ALOX5
SCHEMBL5698710 0.89 PTGS2 (0.76) PTGS2PTGS1CHRNA7ALOX5
SCHEMBL27337910 0.89 RPA1 (0.63) PTGS2RPA1CHRNA7ALOX5SMN1; SMN2
SCHEMBL27499348 0.86 CA9 (0.78) PTGS2PTGS1RPA1CHRNA7ALOX5
SCHEMBL27554183 0.86 CHRNA7 (0.78) PTGS2PTGS1RPA1CHRNA7SMN1; SMN2
SCHEMBL6341643 0.86 PTGS2 (0.82) PTGS2PTGS1CHRNA7SMN1; SMN2CA9
SCHEMBL28294492 0.86 CHRNA7 (0.77) PTGS2PTGS1CHRNA7

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
CN-1202828-A Substituted pyrzolyl benzenesulfonanides for use in veterinary SEARLE & CO (US) 1998-12-23 CN disclosed