SCHEMBL29619627

SCHEMBL29619627

C=CC(=O)OCC(C)(CCCC)COC(=O)C=C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 10/20 0.56
HPGD P15428 1/20 0.56
ALDH1A1 P00352 4/20 0.47
CYP3A4 P08684 3/20 0.47
TP53 P04637 3/20 0.47
HIF1A Q16665 3/20 0.47
MAPK1 P28482 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HSD17B10 Q99714 2/20 0.46
LMNA P02545 2/20 0.46
THRB P10828 4/20 0.44
ATM Q13315 1/20 0.37
NFKB1 P19838 1/20 0.36
ADRA1A P35348 1/20 0.36
RAB9A P51151 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
THRA P10827 1/20 0.34
HCAR2 Q8TDS4 2/20 0.33
ZDHHC20 Q5W0Z9 1/20 0.33
ZDHHC2 Q9UIJ5 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
SCHEMBL24690505 0.93 TSHR (0.53) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL19069168 0.93 TSHR (0.53) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL29038886 0.93 TSHR (0.53) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL18469789 0.92 TSHR (0.51) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL20927039 0.92 TSHR (0.51) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL21166449 0.90 TSHR (0.53) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL18737324 0.90 TSHR (0.53) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL18737331 0.90 TSHR (0.53) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL29524745 0.89 LMNA (0.58) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL27948433 0.88 TSHR (0.51) TSHRHPGDALDH1A1CYP3A4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114539845-A Ink-jet printing solder-resist ink composition and circuit board thereof 惠州市容大感光科技有限公司 2022-05-27 CN claimed
CN-114685790-B Polymer, composition comprising same, and polysiloxane-polyimide material 财团法人工业技术研究院 2024-09-17 CN disclosed
CN-116285486-A Radiation-curable amino (methyl) acrylate resin, ink composition and application thereof 长兴特殊材料(珠海)有限公司 2023-06-23 CN disclosed
CN-114539843-A Ink-jet printing solder-resist ink composition and circuit board thereof 深圳市容大感光科技股份有限公司 2022-05-27 CN disclosed
CN-114539845-A Ink-jet printing solder-resist ink composition and circuit board thereof 惠州市容大感光科技有限公司 2022-05-27 CN disclosed