SCHEMBL11135705

SCHEMBL11135705

O=S(=O)(O)N(S(=O)(=O)O)S(=O)(=O)O.[NaH]

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA5A P35218 2/20 0.42
CA5B Q9Y2D0 2/20 0.42
TSHR P16473 3/20 0.36
CA2 P00918 2/20 0.36
CA1 P00915 1/20 0.36
NT5E P21589 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL10390296 1.00 CA5A (0.42) CA5ACA5BTSHRCA2CA1
SCHEMBL6890356 0.95 CA5A (0.46) CA5ACA5BTSHRCA2CA1
Ammonia Solution, Strong SCHEMBL11123434 0.91 CA5A (0.42) CA5ACA5BTSHRCA2CA1
Ammonia Solution, Strong SCHEMBL11125533 0.91 CA5A (0.42) CA5ACA5BTSHRCA2CA1
SCHEMBL11660051 0.84 CA2 (0.41) CA5ACA5BTSHRCA2CA1
SCHEMBL24982485 0.72 KDM4E (0.33) CA5ACA5BCA2MEN1KMT2A
SCHEMBL21423179 0.72 TSHR (0.47) CA5ACA5BTSHRTDP1
Sulfuric Acid SCHEMBL2323392 0.68 CA5A (0.86) CA5ACA5BTSHRCA2CA1
Sulfuric Acid SCHEMBL8506703 0.68 CA5A (0.86) CA5ACA5BTSHRCA2CA1
Sulfuric Acid SCHEMBL19741763 0.68 CA5A (0.86) CA5ACA5BTSHRCA2CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4374818-A Process for the preparation of alkali metal salts of imidodisulfonic acid HOECHST AKTIENGESELLSCHAFT (DE) 1983-02-22 US disclosed