SCHEMBL28519835

SCHEMBL28519835

CCOC(=O)CC(=O)C(O)O

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.64
MGAM O43451 1/20 0.64
SI P14410 1/20 0.64
MGAM2 Q2M2H8 1/20 0.64
ALDH1A1 P00352 4/20 0.46
TRPA1 O75762 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
KMT2A Q03164 3/20 0.42
POLB P06746 1/20 0.42
LMNA P02545 2/20 0.40
HSD17B10 Q99714 1/20 0.40
CYP1A2 P05177 1/20 0.40
ALOX15 P16050 2/20 0.39
SOAT1 P35610 1/20 0.39
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL9290670 0.84 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL182126 0.81 GAA (0.64) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL28048925 0.79 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL28009465 0.79 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL28048908 0.79 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL4418314 0.79 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL6297051 0.79 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL18890 0.79 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL28825664 0.79 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL138841 0.79 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112143436-B Preparation method of high-temperature and high-humidity resistant polyurethane adhesive 佛山市龙源镭射科技有限公司 2021-05-07 CN claimed
CN-112143436-A Preparation method of high-temperature and high-humidity resistant polyurethane adhesive 钟雨玲 2020-12-29 CN claimed
CN-112143436-B Preparation method of high-temperature and high-humidity resistant polyurethane adhesive 佛山市龙源镭射科技有限公司 2021-05-07 CN disclosed
CN-112143436-A Preparation method of high-temperature and high-humidity resistant polyurethane adhesive 钟雨玲 2020-12-29 CN disclosed