SCHEMBL27554183

SCHEMBL27554183

COc1ccc(-c2cc(C(=O)O)nn2-c2ccc(S(N)(=O)=O)cc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.78
RPA1 P27694 2/20 0.72
PTGS2 P35354 10/20 0.70
CA1 P00915 1/20 0.69
CA2 P00918 1/20 0.69
CA9 Q16790 1/20 0.69
PTGS1 P23219 4/20 0.67
SMN1; SMN2 Q16637 1/20 0.65
MAPK9 P45984 1/20 0.65
MARS1 P56192 1/20 0.62

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
SCHEMBL6351220 0.91 CHRNA7 (0.78) CHRNA7PTGS2CA1CA2CA9
SCHEMBL6342040 0.90 PTGS2 (0.80) CHRNA7PTGS2CA1CA2CA9
SCHEMBL9210332 0.90 RPA1 (0.74) CHRNA7RPA1PTGS2CA1CA2
SCHEMBL9056282 0.89 RPA1 (0.90) CHRNA7RPA1SMN1; SMN2MARS1
SCHEMBL5430032 0.87 CA9 (0.74) CHRNA7RPA1PTGS2CA1CA2
SCHEMBL27485652 0.86 PTGS2 (0.65) CHRNA7RPA1PTGS2CA9PTGS1
SCHEMBL5236666 0.86 RPA1 (0.72) RPA1PTGS2CA1CA2CA9
SCHEMBL3873219 0.85 CHRNA7 (0.80) CHRNA7RPA1PTGS2SMN1; SMN2MAPK9
SCHEMBL27485627 0.85 PTGS2 (0.69) CHRNA7RPA1PTGS2CA1CA2
SCHEMBL5698710 0.85 PTGS2 (0.76) CHRNA7PTGS2PTGS1

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