SCHEMBL8462316

SCHEMBL8462316

CC(=O)NC(=O)c1cc(S(=O)(=O)O)cc(S(=O)(=O)O)c1I(=O)=O

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CASP6 P55212 1/20 0.33
▸ TIMP3 P35625 2/20 0.32
▸ LCK P06239 1/20 0.31
▸ FYN P06241 1/20 0.31
▸ CA1 P00915 2/20 0.31
▸ CA2 P00918 2/20 0.31
▸ CA12 O43570 1/20 0.31
▸ CA7 P43166 1/20 0.31
▸ CA14 Q9ULX7 1/20 0.31
▸ ENPP2 Q13822 1/20 0.30

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
SCHEMBL8459916 0.79 HSD17B10 (0.45) LCKFYNCA1CA2CA12
SCHEMBL8460742 0.77 CASP6 (0.33) CASP6TIMP3LCKFYNCA1
SCHEMBL8463939 0.76 LCK (0.40) CASP6TIMP3LCKFYN
SCHEMBL8464054 0.75 CA1 (0.40) CASP6TIMP3CA1CA2CA12
Phosphoric Acid SCHEMBL8462613 0.68 NT5E (0.41) CASP6TIMP3ENPP2
SCHEMBL8463923 0.68 KDM4E (0.36) LCKCA1CA2
SCHEMBL8462609 0.68 INPPL1 (0.40) CASP6
SCHEMBL8464480 0.68 HSD17B10 (0.50) LCKFYN
SCHEMBL8460365 0.67 SMN1; SMN2 (0.36) —
SCHEMBL8464497 0.67 POLB (0.35) —

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
EP-0745326-B1 Stabilization of aqueous 3-isothiazolone solutions ROHM & HAAS (US) 1999-09-22 — — EP disclosed
US-5594017-A WITH AN IODOSYL OR IODYL COMPOUND ROHM AND HAAS COMPANY (US) 1997-01-14 — — US disclosed
EP-0745326-A1 Stabilization of aqueous 3-isothiazolone solutions ROHM AND HAAS COMPANY (US) 1996-12-04 — — EP disclosed
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