SCHEMBL11277433

SCHEMBL11277433

Nc1cc(N)c(S(=O)(=O)O)cc1S(N)(=O)=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.57
CA1 P00915 5/20 0.57
CA4 P22748 4/20 0.57
CA12 O43570 4/20 0.57
CA9 Q16790 4/20 0.57
CA6 P23280 3/20 0.57
CA5A P35218 3/20 0.57
CA7 P43166 3/20 0.57
CA14 Q9ULX7 3/20 0.57
CA5B Q9Y2D0 3/20 0.57
CA3 P07451 1/20 0.57
ALDH1A1 P00352 4/20 0.53
APEX1 P27695 2/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
KDM4E B2RXH2 2/20 0.41
PKM P14618 2/20 0.41
HSD17B10 Q99714 2/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL427123 0.91 TTR (0.45) CA2CA1CA4CA12CA9
Ammonia Solution, Strong SCHEMBL7550094 0.88 TTR (0.43) CA2CA1CA4CA12CA9
SCHEMBL8829810 0.88 TTR (0.43) CA2CA1CA4CA12CA9
SCHEMBL10870494 0.88 TTR (0.43) CA2CA1CA4CA12CA9
Ammonia Solution, Strong SCHEMBL7550098 0.88 TTR (0.43) CA2CA1CA4CA12CA9
SCHEMBL9646671 0.85 CA1 (0.47) CA2CA1CA4CA12CA9
SCHEMBL9647910 0.84 CA1 (0.78) CA2CA1CA4CA12CA9
SCHEMBL27699058 0.84 CA1 (0.50) CA2CA1CA4CA12CA9
SCHEMBL27699059 0.84 CA1 (0.46) CA2CA1CA4CA12CA9
SCHEMBL27903562 0.84 CA1 (0.78) CA2CA1CA4CA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4341773-A 2,4-Diamino-5-sulfamoylbenzene sulfonic acids and process for their manufacture HOECHST AKTIENGESELLSCHAFT (DE) 1982-07-27 US disclosed
US-4341773-A 2,4-Diamino-5-sulfamoylbenzene sulfonic acids and process for their manufacture HOECHST AKTIENGESELLSCHAFT (DE) 1982-07-27 US disclosed
EP-0035723-A1 2,4-Diamino-5-sulfamoylbenzol-sulfonic acids and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1981-09-16 EP disclosed