SCHEMBL7924838

SCHEMBL7924838

CC(=O)Oc1ccc2nc(S(N)(=O)=O)sc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 20/20 1.00
CA1 P00915 3/20 0.68
KDM4E B2RXH2 1/20 0.66
CA12 O43570 1/20 0.66
LMNA P02545 1/20 0.66
CA3 P07451 1/20 0.66
PKM P14618 1/20 0.66
CA4 P22748 1/20 0.66
CA6 P23280 1/20 0.66
CA5A P35218 1/20 0.66
CA7 P43166 1/20 0.66
KMT2A Q03164 1/20 0.66
HIF1A Q16665 1/20 0.66
CA9 Q16790 1/20 0.66
CA13 Q8N1Q1 1/20 0.66
TDP1 Q9NUW8 1/20 0.66
CA14 Q9ULX7 1/20 0.66
CA5B Q9Y2D0 1/20 0.66

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
SCHEMBL10938807 0.90 CA2 (0.82) CA2CA1CA4
SCHEMBL7933450 0.89 CA2 (0.81) CA2CA1
SCHEMBL11118371 0.89 CA2 (0.80) CA2CA1CA4
SCHEMBL10973463 0.88 CA2 (1.00) CA2CA1KDM4ECA12LMNA
SCHEMBL11054152 0.86 CA2 (1.00) CA2CA1
SCHEMBL2522313 0.86 CA2 (1.00) CA2CA1
SCHEMBL7924856 0.86 CA2 (0.82) CA2CA1KDM4ECA12LMNA
SCHEMBL10973390 0.85 CA2 (0.86) CA2CA1CA4
SCHEMBL7937406 0.85 CA2 (0.82) CA2CA1
SCHEMBL7937408 0.85 CA2 (0.82) CA2CA1

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-6313155-B1 Composition and method for treating macular disorders BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2001-11-06 US claimed
EP-0070239-B1 BENZOTHIAZOLESULFONAMIDE DERIVATIVES, THEIR PREPARATION AND OPHTHALMIC COMPOSITIONS CONTAINING SAID DERIVATIVES MERCK & CO. INC. (US) 1985-06-05 EP claimed
EP-0070239-A1 Benzothiazolesulfonamide derivatives, their preparation and ophthalmic compositions containing said derivatives MERCK & CO. INC. (US) 1983-01-19 EP claimed
EP-0070239-B1 BENZOTHIAZOLESULFONAMIDE DERIVATIVES, THEIR PREPARATION AND OPHTHALMIC COMPOSITIONS CONTAINING SAID DERIVATIVES MERCK & CO. INC. (US) 1985-06-05 EP disclosed
US-4416890-A GLAUCOMA TREATMENT MERCK & CO., INC. (US) 1983-11-22 US disclosed
EP-0070239-A1 Benzothiazolesulfonamide derivatives, their preparation and ophthalmic compositions containing said derivatives MERCK & CO. INC. (US) 1983-01-19 EP disclosed