SCHEMBL9219362

SCHEMBL9219362

CCOC(=O)C1S(=O)(=O)CCCS1(=O)=O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 7/20 0.37
PPM1B O75688 1/20 0.36
PTPN1 P18031 1/20 0.36
PPP1CC P36873 1/20 0.36
MAPT P10636 3/20 0.35
HSD17B10 Q99714 2/20 0.34
LMNA P02545 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL7443339 0.77 L3MBTL1 (0.40) L3MBTL1ALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL31715666 0.67 ALDH1A1 (0.50) L3MBTL1ALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL70576 0.67 PPM1B (0.42) L3MBTL1ALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL2705849 0.66 ALDH1A1 (0.48) ALDH1A1PPM1BPTPN1PPP1CCMAPT
SCHEMBL1296897 0.66 ALDH1A1 (0.48) ALDH1A1PPM1BPTPN1PPP1CCMAPT
SCHEMBL8914013 0.66 ALDH1A1 (0.48) ALDH1A1PPM1BPTPN1PPP1CCMAPT
SCHEMBL2705851 0.66 ALDH1A1 (0.48) ALDH1A1PPM1BPTPN1PPP1CCMAPT
SCHEMBL12943060 0.66 ALDH1A1 (0.48) ALDH1A1PPM1BPTPN1PPP1CCMAPT
SCHEMBL6899600 0.66 TP53 (0.48) ALDH1A1PPM1BPTPN1PPP1CCMAPT
SCHEMBL594647 0.66 TP53 (0.48) ALDH1A1PPM1BPTPN1PPP1CCMAPT

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-5401722-A Peptide analogues MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-03-28 US disclosed