SCHEMBL20924927

SCHEMBL20924927

CCOC(=O)C(=O)C1=C(O)C2CCC1C2

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.36
MAPT P10636 2/20 0.36
CYP2C9 P11712 2/20 0.34
GAA P10253 1/20 0.34
ALDH1A1 P00352 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
HTT P42858 1/20 0.34
ATM Q13315 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
HPGD P15428 1/20 0.34
ESR2 Q92731 1/20 0.33
FDFT1 P37268 1/20 0.33
SLC6A3 Q01959 1/20 0.33
RAB9A P51151 1/20 0.33
GLO1 Q04760 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
SCHEMBL5179724 0.84 KDM4E (0.42) MAPTGAAALDH1A1HTTHPGD
SCHEMBL4934353 0.83 MAPT (0.34) MAPTCYP2C9GAAALDH1A1L3MBTL1
SCHEMBL2328254 0.75 LMNA (0.47) MAPTCYP2C9GAAALDH1A1HTT
SCHEMBL5429764 0.75 LMNA (0.47) MAPTCYP2C9GAAALDH1A1HTT
SCHEMBL17420713 0.69 CYP2C9 (0.48) MAPTCYP2C9ALDH1A1L3MBTL1HTT
SCHEMBL684824 0.68 MAPT (0.33) MAPTGAAALDH1A1L3MBTL1HPGD
SCHEMBL679446 0.68 MAPT (0.33) MAPTGAAALDH1A1L3MBTL1HPGD
SCHEMBL7117758 0.67 LMNA (0.40) MAPTCYP2C9GAAALDH1A1HTT
SCHEMBL31296900 0.66 LMNA (0.50) MAPTCYP2C9GAAALDH1A1HTT
SCHEMBL21517404 0.65 CA12 (0.34) MAPTGAAALDH1A1L3MBTL1ESR2

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
EP-3473098-A1 COMPOSITION FOR REGULATING PLANT GROWTH, METHOD FOR TREATING PLANTS THEREWITH, AND ACTIVE INGREDIENT THEREOF Gorbunov, Sergei Valeryevich (RU) 2019-04-24 EP disclosed