SCHEMBL28575386

SCHEMBL28575386

O=C(O)CCC(=S)OCC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.45
EGLN1 Q9GZT9 4/20 0.45
ALKBH5 Q6P6C2 1/20 0.45
SUCNR1 Q9BXA5 1/20 0.45
PAM P19021 3/20 0.38
TSHR P16473 2/20 0.36
CTH P32929 1/20 0.36
CBS P35520 1/20 0.36
THPO P40225 1/20 0.36
SLC15A2 Q16348 1/20 0.36
MAPK1 P28482 1/20 0.36
SLC13A3 Q8WWT9 1/20 0.36
OR51E2 Q9H255 1/20 0.36
SLC22A6 Q4U2R8 1/20 0.35
THRB P10828 1/20 0.35
KDM5C P41229 3/20 0.33
PHF8 Q9UPP1 3/20 0.33
KDM2A Q9Y2K7 3/20 0.33
KDM6B O15054 2/20 0.33
KDM4E B2RXH2 2/20 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
SCHEMBL28579133 0.86 PAM (0.48) LMNAEGLN1PAMTSHRCTH
SCHEMBL10826601 0.84 LMNA (0.48) LMNAEGLN1PAMTSHRCTH
SCHEMBL28131652 0.80 LMNA (0.45) LMNAEGLN1ALKBH5SUCNR1TSHR
SCHEMBL28131658 0.78 LMNA (0.43) LMNAEGLN1ALKBH5SUCNR1TSHR
SCHEMBL28132385 0.78 LMNA (0.43) LMNAEGLN1ALKBH5SUCNR1TSHR
Ammonia Solution, Strong SCHEMBL2546315 0.78 LMNA (0.43) LMNAEGLN1ALKBH5SUCNR1TSHR
SCHEMBL28137573 0.78 LMNA (0.43) LMNAEGLN1ALKBH5SUCNR1TSHR
SCHEMBL27872251 0.78 LMNA (0.43) LMNAEGLN1ALKBH5SUCNR1TSHR
SCHEMBL530330 0.74 PAM (0.56) LMNAEGLN1ALKBH5SUCNR1PAM
SCHEMBL4399425 0.73 TSHR (0.43) LMNAEGLN1ALKBH5SUCNR1PAM

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-113004500-A PETG material for manufacturing cosmetic bottle body or pipe body and preparation method thereof 金华市兆亿塑业有限公司 2021-06-22 CN claimed