SCHEMBL7329255

SCHEMBL7329255

COC(C(=O)OCN1C(=O)C2=C(C3CCC2CC3)S1(=O)=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ELANE P08246 9/20 0.51
CCNA2 P20248 2/20 0.38
CDK2 P24941 2/20 0.38
CCNA1 P78396 2/20 0.38
RAB9A P51151 2/20 0.35
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
CHRM1 P11229 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
SCHEMBL7330922 0.94 ELANE (0.59) ELANECCNA2CDK2CCNA1RAB9A
Methyl Alcohol SCHEMBL7329268 0.79 ELANE (0.52) ELANEALDH1A1
SCHEMBL8866035 0.73 ELANE (0.88) ELANE
SCHEMBL7305365 0.67 ELANE (0.51) ELANE
SCHEMBL7337549 0.67 ELANE (0.58) ELANEALDH1A1
SCHEMBL2312705 0.65 MMP8 (0.54) ALDH1A1GAA
SCHEMBL12951609 0.65 MMP8 (0.54) ALDH1A1GAA
SCHEMBL4599256 0.65 MMP8 (0.54) ALDH1A1GAA
SCHEMBL7305820 0.64 ELANE (0.42) ELANE
SCHEMBL12987479 0.64 KMT2A (0.47) ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5783589-A 2-saccharinylmethyl aryl and arloxy acetates useful as proteolytic enzyme inhibitors and compositions and method of use thereof SANOFI (FR) 1998-07-21 US disclosed
US-5489604-A TREATING DEGENERATIVE DISEASES STERLING WINTHROP, INC. (US) 1996-02-06 US disclosed
US-5385923-A Treatment of degenerative diseases STERLING WINTHROP INC. (US) 1995-01-31 US disclosed
EP-0550112-A1 2-Saccharinylmethyl aryl and aryloxy acetates useful as proteolytic enzyme inhibitors and pharmaceutical compositions contaning them STERLING WINTHROP INC. (US) 1993-07-07 EP disclosed