P-Toluenesulfonamide

P-Toluenesulfonamide

SCHEMBL8376382

Cc1ccc(S(N)(=O)=O)cc1.Cc1ccc(S(N)(=O)=O)cc1.[SeH2]

nearest known ligand 0.95

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 11/20 0.95
CA9 Q16790 10/20 0.95
CA12 O43570 9/20 0.95
CA1 P00915 8/20 0.95
CA7 P43166 4/20 0.95
CA6 P23280 3/20 0.95
CA5A P35218 3/20 0.95
CA5B Q9Y2D0 3/20 0.95
CA3 P07451 2/20 0.95
PTPN7 P35236 1/20 0.62
PTGS2 P35354 5/20 0.60
PTGS1 P23219 2/20 0.60
GAA P10253 1/20 0.59
CA4 P22748 3/20 0.58
CA13 Q8N1Q1 2/20 0.56
CA14 Q9ULX7 2/20 0.56
USP2 O75604 1/20 0.56
TSHR P16473 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
AGO2 Q9UKV8 1/20 0.56

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
P-Toluenesulfonamide SCHEMBL1331323 0.97 CA2 (1.00) CA2CA9CA12CA1CA7
P-Toluenesulfonamide SCHEMBL31527821 0.97 CA2 (1.00) CA2CA9CA12CA1CA7
P-Toluenesulfonamide SCHEMBL7370 0.97 CA2 (1.00) CA2CA9CA12CA1CA7
P-Toluenesulfonamide SCHEMBL357964 0.95 CA2 (0.95) CA2CA9CA12CA1CA7
P-Toluenesulfonamide SCHEMBL8070437 0.95 CA2 (0.95) CA2CA9CA12CA1CA7
P-Toluenesulfonamide SCHEMBL8071454 0.95 CA2 (0.95) CA2CA9CA12CA1CA7
P-Toluenesulfonamide SCHEMBL9377640 0.95 CA2 (0.95) CA2CA9CA12CA1CA7
P-Toluenesulfonamide SCHEMBL8376384 0.95 CA2 (0.95) CA2CA9CA12CA1CA7
P-Toluenesulfonamide SCHEMBL15401330 0.95 CA2 (0.95) CA2CA9CA12CA1CA7
P-Toluenesulfonamide SCHEMBL391243 0.95 CA2 (0.95) CA2CA9CA12CA1CA7

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5869472-A Synthesis of 1α-hydroxy vitamin D BONE CARE INTERNATIONAL, INC. (US) 1999-02-09 US claimed
EP-0865427-A1 SYNTHESIS OF 1ALPHA-HYDROXY VITAMIN D BONE CARE INTERNATIONAL, INC. (US) 1998-09-23 EP claimed
WO-1996002501-A1 SYNTHESIS OF 1α-HYDROXY VITAMIN D LUNAR CORPORATION (US) 1996-02-01 WO claimed
US-5869472-A Synthesis of 1α-hydroxy vitamin D BONE CARE INTERNATIONAL, INC. (US) 1999-02-09 US disclosed
EP-0865427-A1 SYNTHESIS OF 1ALPHA-HYDROXY VITAMIN D BONE CARE INTERNATIONAL, INC. (US) 1998-09-23 EP disclosed
WO-1996002501-A1 SYNTHESIS OF 1α-HYDROXY VITAMIN D LUNAR CORPORATION (US) 1996-02-01 WO disclosed