SCHEMBL8001834

SCHEMBL8001834

CCOC(=O)C1=C(O)c2ccccc2S(=O)(=O)N1

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.55
PTGES O14684 7/20 0.53
PTGS2 P35354 4/20 0.50
KDM4E B2RXH2 1/20 0.49
CA12 O43570 1/20 0.49
USP2 O75604 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
LMNA P02545 1/20 0.49
BCHE P06276 1/20 0.49
CA4 P22748 1/20 0.49
CA6 P23280 1/20 0.49
CA5A P35218 1/20 0.49
CA7 P43166 1/20 0.49
KMT2A Q03164 1/20 0.49
CA9 Q16790 1/20 0.49
CA14 Q9ULX7 1/20 0.49
CA5B Q9Y2D0 1/20 0.49

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
SCHEMBL10962793 0.85 PTGES (0.50) PTGESPTGS2
SCHEMBL10509937 0.85 PTGES (0.49) PTGESPTGS2KDM4ECA12USP2
SCHEMBL30940077 0.84 PTGES (0.56) PTGESPTGS2KDM4ECA12USP2
SCHEMBL7342661 0.84 PTGES (0.56) PTGESPTGS2KDM4ECA12USP2
SCHEMBL11882115 0.83 RHOA (0.54) PTGESPTGS2KDM4ECA12USP2
SCHEMBL10564755 0.81 PTGES (0.53) PTGESPTGS2KDM4ECA12USP2
SCHEMBL4505248 0.79 PTGES (0.57) PTGESPTGS2KDM4ECA12USP2
Ethylparaben SCHEMBL16416596 0.78 CA12 (0.56) HSD11B1KDM4ECA12USP2CA1
SCHEMBL6720568 0.77 PTGES (0.62) PTGESPTGS2KDM4ECA12USP2
Saccharin SCHEMBL29283763 0.77 CA12 (0.65) HSD11B1KDM4ECA12USP2CA1

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
WO-2001040208-A2 PROCESS FOR SYNTHESIS OF 4-HYDROXY-2H-1,2-BENZOTHIAZINE-3-CARBOXAMIDES AD 'ZDRAVLJE' (YU) 2001-06-08 WO claimed
US-4116964-A 2-[(N-2-pyridylcarbamoyl)methyl]saccharin WARNER-LAMBERT COMPANY (US) 1978-09-26 US disclosed
US-4074048-A Process for the preparation of 4-hydroxy-2H-1,2-benzothiazine-3-carboxamide 1,1-dioxides WARNER-LAMBERT COMPANY (US) 1978-02-14 US disclosed