Saccharin

Saccharin

SCHEMBL11399526

O=C1NS(=O)(=O)c2ccccc21.[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH].[NaH]

nearest known ligand 0.96

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 7/20 0.96
CA9 Q16790 7/20 0.96
CA2 P00918 5/20 0.96
CA1 P00915 4/20 0.96
CA7 P43166 3/20 0.96
KDM4E B2RXH2 3/20 0.96
CA4 P22748 2/20 0.96
USP2 O75604 1/20 0.96
LMNA P02545 1/20 0.96
BCHE P06276 1/20 0.96
CA6 P23280 1/20 0.96
CA5A P35218 1/20 0.96
KMT2A Q03164 1/20 0.96
CA14 Q9ULX7 1/20 0.96
CA5B Q9Y2D0 1/20 0.96
ALDH1A1 P00352 3/20 0.58
RET P07949 2/20 0.53
GRK5 P34947 2/20 0.53
TYRO3 Q06418 2/20 0.53
DYRK1B Q9Y463 2/20 0.53

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
Saccharin SCHEMBL3373 1.00 CA12 (0.96) CA12CA9CA2CA1CA7
Saccharin SCHEMBL10627242 1.00 CA12 (0.96) CA12CA9CA2CA1CA7
Saccharin SCHEMBL3374 1.00 CA12 (0.96) CA12CA9CA2CA1CA7
Saccharin SCHEMBL8802065 1.00 CA12 (0.96) CA12CA9CA2CA1CA7
Saccharin SCHEMBL10899217 1.00 CA12 (0.96) CA12CA9CA2CA1CA7
Saccharin SCHEMBL514398 1.00 CA12 (0.96) CA12CA9CA2CA1CA7
Saccharin SCHEMBL4624412 1.00 CA12 (0.96) CA12CA9CA2CA1CA7
Saccharin SCHEMBL9463482 1.00 CA12 (0.96) CA12CA9CA2CA1CA7
Saccharin SCHEMBL9463164 1.00 CA12 (0.96) CA12CA9CA2CA1CA7
Saccharin SCHEMBL8214948 1.00 CA12 (0.96) CA12CA9CA2CA1CA7

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-4251526-A HYPOTENSIVE AGENTS AND ANTIPSYCHOTIC PHARMACIA & UPJOHN COMPANY 1981-02-17 US disclosed