SCHEMBL7305039

SCHEMBL7305039

O=C(OCN1C(=O)C2=C(C3CCC2C3)S1(=O)=O)c1ccoc1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ELANE P08246 14/20 0.63
PTPN1 P18031 1/20 0.35
PTPN6 P29350 1/20 0.35
PTPN11 Q06124 1/20 0.35
TPSAB1 Q15661 5/20 0.32
TPSD1 Q9BZJ3 5/20 0.32
TPSG1 Q9NRR2 5/20 0.32
PARL Q9H300 1/20 0.32

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
SCHEMBL7304572 0.79 ELANE (0.58) ELANE
SCHEMBL7297808 0.78 ELANE (0.57) ELANE
SCHEMBL7438739 0.77 ELANE (1.00) ELANE
SCHEMBL7306702 0.75 ELANE (0.61) ELANE
Methyl Alcohol SCHEMBL7330929 0.72 ELANE (0.60) ELANETPSAB1TPSD1TPSG1
SCHEMBL7332156 0.72 ELANE (0.59) ELANETPSAB1TPSD1TPSG1PARL
SCHEMBL7304995 0.67 ELANE (0.52) ELANE
SCHEMBL7295634 0.65 ELANE (0.44) ELANE
SCHEMBL7336876 0.65 ELANE (0.51) ELANETPSAB1TPSD1TPSG1PARL
SCHEMBL28479582 0.64 MEN1 (0.60)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0550111-B1 2-Saccharinylmethyl heterocyclic carboxylates useful as proteolytic enzyme inhibitors and pharmaceutical compositions containing them SANOFI SA (FR) 1999-04-14 EP disclosed
EP-0550111-A1 2-Saccharinylmethyl heterocyclic carboxylates useful as proteolytic enzyme inhibitors and pharmaceutical compositions containing them STERLING WINTHROP INC. (US) 1993-07-07 EP disclosed