SCHEMBL28756540

SCHEMBL28756540

C=C(C)C(=O)OCc1ccc(OCCO)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
APEX1 P27695 1/20 0.52
HTT P42858 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
GAA P10253 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
MAPT P10636 1/20 0.42
NR1I2 O75469 1/20 0.41
MAOB P27338 5/20 0.41
ALDH1A1 P00352 1/20 0.41
RECQL P46063 1/20 0.41
MAOA P21397 1/20 0.40
APP P05067 2/20 0.40
NAAA Q02083 1/20 0.39
ASAH1 Q13510 1/20 0.39
CYP3A4 P08684 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL455205 0.84 ALDH1A1 (0.49) POLBAPEX1HTTTDP1L3MBTL1
SCHEMBL254038 0.83 ALDH1A1 (0.50) POLBAPEX1HTTTDP1L3MBTL1
SCHEMBL19727703 0.82 GPR174 (0.45) POLBAPEX1HTTTDP1MAPT
SCHEMBL10904059 0.82 POLB (0.44) POLBAPEX1HTTTDP1MAPT
SCHEMBL24019226 0.82 ALDH1A1 (0.46) POLBAPEX1HTTTDP1MAPT
SCHEMBL16125663 0.82 ALDH1A1 (0.46) POLBAPEX1HTTTDP1MAPT
SCHEMBL7785612 0.82 RARB (0.51) POLBAPEX1HTTTDP1ALDH1A1
SCHEMBL14749610 0.81 POLB (0.49) POLBAPEX1HTTTDP1GAA
SCHEMBL453318 0.81 ALDH1A1 (0.53) POLBHTTMAPTALDH1A1SMN1; SMN2
SCHEMBL10204581 0.81 ELANE (0.53) POLBAPEX1HTTTDP1GAA

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-111601858-B Fluorinated elastomers cured by actinic radiation and methods thereof 3M创新有限公司 2022-06-21 CN disclosed
CN-111601858-A Fluorinated elastomers cured by actinic radiation and methods thereof 3M创新有限公司 2020-08-28 CN disclosed