SCHEMBL27859554

SCHEMBL27859554

COCCOC(=O)C(=O)OCCOC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.48
THRB P10828 2/20 0.39
ALDH1A1 P00352 6/20 0.39
SMN1; SMN2 Q16637 1/20 0.35
GAA P10253 2/20 0.34
RAB9A P51151 1/20 0.34
MAPT P10636 3/20 0.34
KDM4E B2RXH2 2/20 0.34
KMT2A Q03164 2/20 0.34
LMNA P02545 1/20 0.34
HSP90AA1 P07900 1/20 0.34
CHRM5 P08912 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
RECQL P46063 1/20 0.33
XIAP P98170 1/20 0.33
PLEC Q15149 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
SCHEMBL14155764 0.92 THRB (0.45) TSHRTHRBALDH1A1SMN1; SMN2MAPT
SCHEMBL22587297 0.92 THRB (0.45) TSHRTHRBALDH1A1SMN1; SMN2MAPT
SCHEMBL4675894 0.86 TSHR (0.43) TSHRTHRBALDH1A1SMN1; SMN2GAA
SCHEMBL3012356 0.86 TSHR (0.43) TSHRTHRBALDH1A1SMN1; SMN2GAA
SCHEMBL9299458 0.85 THRB (0.61) TSHRTHRBALDH1A1SMN1; SMN2GAA
SCHEMBL9453423 0.85 ALDH1A1 (0.54) TSHRALDH1A1SMN1; SMN2LMNAHPGD
Ammonia Solution, Strong SCHEMBL27732660 0.84 TSHR (0.42) TSHRTHRBALDH1A1SMN1; SMN2GAA
SCHEMBL10517319 0.84 TSHR (0.42) TSHRTHRBALDH1A1SMN1; SMN2GAA
SCHEMBL28516596 0.84 THRB (0.43) TSHRTHRBALDH1A1SMN1; SMN2GAA
Ammonia Solution, Strong SCHEMBL27753009 0.84 TSHR (0.42) TSHRTHRBALDH1A1SMN1; SMN2GAA

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-102271691-A Natural silver disinfectant compositions 2011-12-07 CN disclosed