SCHEMBL5826033

SCHEMBL5826033

CCCOC(=O)C1CSCN1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 1/20 0.37
PTPN1 P18031 1/20 0.37
PPP1CC P36873 1/20 0.37
ALDH1A1 P00352 2/20 0.32
USP2 O75604 1/20 0.32
GAA P10253 1/20 0.32
KDM4E B2RXH2 1/20 0.32
GLA P06280 1/20 0.32
HCAR2 Q8TDS4 1/20 0.31

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
SCHEMBL6706697 0.86 ALDH1A1 (0.37) PPM1BPTPN1PPP1CCALDH1A1GAA
SCHEMBL29140392 0.86 ALDH1A1 (0.37) PPM1BPTPN1PPP1CCALDH1A1GAA
Hydrochloric Acid SCHEMBL28434875 0.84 KDM4E (0.38) PPM1BPTPN1PPP1CCALDH1A1KDM4E
Hydrochloric Acid SCHEMBL29393853 0.84 KDM4E (0.38) PPM1BPTPN1PPP1CCALDH1A1KDM4E
Hydrochloric Acid SCHEMBL7954813 0.84 KDM4E (0.38) PPM1BPTPN1PPP1CCALDH1A1KDM4E
SCHEMBL28749356 0.79
SCHEMBL25885236 0.78 PPM1B (0.45) PPM1BPTPN1PPP1CCALDH1A1HCAR2
SCHEMBL15083352 0.78
SCHEMBL836017 0.77
SCHEMBL3361966 0.76

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
JP-2006210753-A ELECTROLYTIC SOLUTION FOR DRIVING ELECTROLYTIC CAPACITOR NICHICON CORP 2006-08-10 JP disclosed