SCHEMBL9866053

SCHEMBL9866053

Cc1ccc(-c2nsc(S(N)(=O)=O)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.43
CA1 P00915 5/20 0.43
CA12 O43570 5/20 0.43
CA9 Q16790 5/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TSHR P16473 1/20 0.43
CA3 P07451 1/20 0.42
CA6 P23280 1/20 0.42
CA5A P35218 1/20 0.42
CA7 P43166 1/20 0.42
CA5B Q9Y2D0 1/20 0.42
RXFP1 Q9HBX9 2/20 0.41
ADORA3 P0DMS8 2/20 0.41
CYP19A1 P11511 1/20 0.40
PTGS2 P35354 3/20 0.38
PTGS1 P23219 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL8999503 0.84 KMT2A (0.44) MEN1KMT2ATSHRRXFP1ADORA3
SCHEMBL9868097 0.84 CYP19A1 (0.58) CA2CA1CA12CA9MEN1
SCHEMBL9869169 0.83 CA2 (0.47) CA2CA1CA12CA9CA5A
SCHEMBL9866328 0.83 NPC1 (0.49) CA2CA1CA12CA9MEN1
SCHEMBL9867816 0.83 HSD17B1 (0.46) CA2CA1CA12CA9MEN1
SCHEMBL9867067 0.82 ADORA3 (0.56) CA2CA1CA12CA9MEN1
SCHEMBL9867503 0.82 ADORA3 (0.52) CA2CA1CA12CA9CA5A
SCHEMBL9868776 0.82 CYP19A1 (0.40) CA2CA1CA12CA9MEN1
SCHEMBL14755599 0.81 GAA (0.48) CA2CA1CA12CA9MEN1
SCHEMBL9869306 0.81 RAB9A (0.49) CA2CA1MEN1KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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