SCHEMBL9869169

SCHEMBL9869169

NS(=O)(=O)c1nc(-c2ccc(Br)cc2)ns1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.47
CA9 Q16790 6/20 0.47
CA12 O43570 5/20 0.47
CA1 P00915 6/20 0.43
LMNA P02545 2/20 0.43
PTGS2 P35354 1/20 0.41
PLCG1 P19174 1/20 0.41
MAPT P10636 4/20 0.40
TP53 P04637 4/20 0.40
THRB P10828 2/20 0.40
CA4 P22748 2/20 0.40
CA5A P35218 2/20 0.40
CA5B Q9Y2D0 2/20 0.40
CYP19A1 P11511 1/20 0.40
RXFP1 Q9HBX9 2/20 0.37

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
SCHEMBL9868097 0.84 CYP19A1 (0.58) CA2CA9CA12CA1LMNA
SCHEMBL9866053 0.83 CA2 (0.43) CA2CA9CA12CA1PTGS2
SCHEMBL9867816 0.83 HSD17B1 (0.46) CA2CA9CA12CA1LMNA
SCHEMBL9866328 0.83 NPC1 (0.49) CA2CA9CA12CA1LMNA
SCHEMBL8999461 0.83 PLCG1 (0.51) CA2CA9CA12LMNAPTGS2
SCHEMBL9867067 0.82 ADORA3 (0.56) CA2CA9CA12CA1LMNA
SCHEMBL9868864 0.79 KIF11 (0.51) CA2CA9CA1PTGS2
SCHEMBL9868776 0.79 CYP19A1 (0.40) CA2CA9CA12CA1LMNA
SCHEMBL9867503 0.79 ADORA3 (0.52) CA2CA9CA12CA1PTGS2
SCHEMBL9867247 0.78 CA2 (0.54) CA2CA9CA12CA1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4985450-A TREATMENT OF GLAUCOMA AVENTIS PHARMACEUTICALS INC. 1991-01-15 US claimed
US-4985450-A TREATMENT OF GLAUCOMA AVENTIS PHARMACEUTICALS INC. 1991-01-15 US disclosed
US-4873239-A GLAUCOMA TREATMENT HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1989-10-10 US disclosed
EP-0276822-A1 Arylthiadiazolylsulfonamides and derivatives, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1988-08-03 EP disclosed
US-4758578-A Arylthiadiazolylsulfonamides, pharmaceutical compositions and use HOECHST ROUSSEL PHARMACEUTICALS, INC. (US) 1988-07-19 US disclosed