SCHEMBL29258043

SCHEMBL29258043

CCOC(=O)C1NCSCCC1=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.34
KDM4E B2RXH2 4/20 0.34
MAPT P10636 4/20 0.34
GAA P10253 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PPM1B O75688 1/20 0.33
PTPN1 P18031 1/20 0.33
PPP1CC P36873 1/20 0.33
TSHR P16473 1/20 0.32
PARP1 P09874 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
SCHEMBL6353034 0.79 MAPT (0.38) ALDH1A1KDM4EMAPTGAAMEN1
SCHEMBL23002174 0.76 CYP2D6 (0.38) ALDH1A1KDM4EMAPTGAAMEN1
SCHEMBL8489133 0.73 ALDH1A1 (0.43) ALDH1A1KDM4EMAPTGAAMEN1
SCHEMBL1846269 0.72 ALDH1A1 (0.45) ALDH1A1KDM4EMAPTGAAMEN1
Hydrochloric Acid SCHEMBL7953483 0.70 KDM4E (0.36) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL9510438 0.69 KDM4E (0.39) ALDH1A1KDM4EMAPTGAAMEN1
SCHEMBL29140392 0.67 ALDH1A1 (0.37) ALDH1A1KDM4EMAPTGAAMEN1
SCHEMBL6706697 0.67 ALDH1A1 (0.37) ALDH1A1KDM4EMAPTGAAMEN1
SCHEMBL29258046 0.67 ALDH1A1 (0.40) ALDH1A1KDM4EMAPTGAAMEN1
Hydrochloric Acid SCHEMBL7954813 0.66 KDM4E (0.38) ALDH1A1KDM4EMAPTHSD17B10PPM1B

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
CN-113603683-B Substituted phenyl oxazolidinones for antimicrobial treatment 结核病药物开发全球联盟公司 2024-06-14 CN disclosed