SCHEMBL28568205

SCHEMBL28568205

C=C(C)C(=O)OC.CC(O)C(=O)OC(=O)/C=C\C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
HCAR2 Q8TDS4 9/20 0.43
TSHR P16473 1/20 0.39
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALOX15 P16050 1/20 0.34
RECQL P46063 1/20 0.34
HSD17B10 Q99714 1/20 0.34
GAA P10253 1/20 0.33
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31

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
Methacrylic Acid SCHEMBL28568084 0.87 HCAR2 (0.44) ALDH1A1HCAR2TSHRKDM4EMAPT
SCHEMBL11859589 0.83 HCAR2 (0.54) ALDH1A1HCAR2TSHRKDM4EMAPT
SCHEMBL2079639 0.83 HCAR2 (0.54) ALDH1A1HCAR2TSHRKDM4EMAPT
SCHEMBL989416 0.83 HCAR2 (0.54) ALDH1A1HCAR2TSHRKDM4EMAPT
Acrylic Acid Methyl Ester SCHEMBL28567664 0.81 HCAR2 (0.50) ALDH1A1HCAR2TSHRKDM4EMAPT
SCHEMBL28913590 0.81 HCAR2 (0.54) ALDH1A1HCAR2TSHRMAPTTDP1
SCHEMBL5078552 0.81 TSHR (0.45) ALDH1A1HCAR2TSHRKDM4EMAPT
Acrylic Acid SCHEMBL28914099 0.80 HCAR2 (0.47) ALDH1A1HCAR2TSHRKDM4EMAPT
Maleic Acid SCHEMBL8629341 0.80 ALDH1A1 (0.71) ALDH1A1HCAR2TSHRKDM4EMAPT
Fumaric Acid SCHEMBL10815593 0.80 ALDH1A1 (0.71) ALDH1A1HCAR2TSHRKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112898497-B Polylactic acid-based macromonomer and preparation method and application thereof 华南师范大学 2022-04-26 CN disclosed
CN-112898497-A Polylactic acid-based macromonomer and preparation method and application thereof 华南师范大学 2021-06-04 CN disclosed