SCHEMBL3137233

SCHEMBL3137233

CC(=O)OCC=C(C)C=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.48
ALOX15 P16050 2/20 0.48
HSD17B10 Q99714 2/20 0.40
LMNA P02545 1/20 0.40
PTPN1 P18031 1/20 0.40
BTN3A1 O00481 1/20 0.37
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
SLCO1B3 Q9NPD5 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
SLCO1B1 Q9Y6L6 1/20 0.35
CHRM5 P08912 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
PGR P06401 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
HTR1A P08908 1/20 0.33
CHRNB2 P17787 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
SCHEMBL3137231 1.00 ALDH1A1 (0.48) ALDH1A1ALOX15HSD17B10LMNAPTPN1
SCHEMBL7848629 1.00 ALDH1A1 (0.48) ALDH1A1ALOX15HSD17B10LMNAPTPN1
SCHEMBL8022947 0.84 ALDH1A1 (0.41) ALDH1A1ALOX15HSD17B10LMNAPTPN1
SCHEMBL11600807 0.82 ALDH1A1 (0.49) ALDH1A1ALOX15HSD17B10LMNAPTPN1
SCHEMBL11785322 0.82 ALDH1A1 (0.71) ALDH1A1ALOX15PTPN1
SCHEMBL1070989 0.82 ALDH1A1 (0.71) ALDH1A1ALOX15PTPN1
SCHEMBL11600809 0.82 ALDH1A1 (0.49) ALDH1A1ALOX15HSD17B10LMNAPTPN1
SCHEMBL1070992 0.82 ALDH1A1 (0.71) ALDH1A1ALOX15PTPN1
SCHEMBL13288245 0.81 ALDH1A1 (0.69) ALDH1A1ALOX15PTPN1
SCHEMBL6765418 0.80 NAAA (0.36) ALDH1A1ALOX15HSD17B10LMNABTN3A1

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 409 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115974690-B Preparation method of 4-acetoxyl-2-methyl-2-butene-1-aldehyde 广州智特奇生物科技股份有限公司 2025-06-13 CN claimed
CN-119977806-A Method for preparing 4-acetoxyl-2-methyl-2-butenal 浙江芳原馨生物医药有限公司 2025-05-13 CN claimed
US-20250083137-A1 SUPPORTED HYDROFORMYLATION CATALYST AND PREPARATION METHOD THEREOF, AND METHOD FOR SYNTHESIZING 4-ACETYLOXY-2-METHYL-2-BUTENAL SHAOXING UNIVERSITY (CN) 2025-03-13 US claimed
CN-116082206-B Preparation method of vitamin A 万华化学集团股份有限公司 2025-02-18 CN claimed
CN-118684579-A Method for preparing 2-methyl-4-acetoxyl-2-butenal by one-step method 浙江芳原馨生物医药有限公司 2024-09-24 CN claimed
CN-114835577-B Aldehyde synthesis method 安徽智新生化有限公司 2024-04-19 CN claimed
WO-2023108327-A1 PREPARATION METHOD FOR LIGHT-COLORED VITAMIN A 万华化学集团股份有限公司 2023-06-22 WO claimed
CN-113603592-B Preparation method of 2-methyl-4-acetoxyl-2-butenal with thermal stability 万华化学集团股份有限公司 2023-05-30 CN claimed
CN-116082206-A Preparation method of vitamin A 万华化学集团股份有限公司 2023-05-09 CN claimed
CN-115974690-A Preparation method of 4-acetoxyl-2-methyl-2-butene-1-aldehyde 广州智特奇生物科技股份有限公司 2023-04-18 CN claimed
CN-103553917-A Method for preparing 3,7,11-trimethyl-2,4,6,10-dodecyl tetrenol acetic acid ester and application thereof UNIV SHAOXING 2014-02-05 CN claimed
CN-103553918-A Preparation method and application of terpenoid 3,7,11-trimethyl-2,4,6,10-dodecatetraene-1-alcohol acetate UNIV SHAOXING 2014-02-05 CN claimed
CN-103553916-A Preparation method and application of 3,7,11-trimethyl-2,4,6,10-dodecatetraene-1-alcohol acetate UNIV SHAOXING 2014-02-05 CN claimed
EP-2665698-A1 PREPARATION OF 4-ACETOXY-2-METHYLBUTANAL BY CATALYTIC CARBON CARBON DOUBLE BOND HYDROGENATION DSM IP Assets B.V. (NL) 2013-11-27 EP claimed
WO-2012098067-A1 PREPARATION OF 4-ACETOXY-2-METHYLBUTANAL BY CATALYTIC CARBON CARBON DOUBLE BOND HYDROGENATION DSM IP ASSETS B.V. (NL) 2012-07-26 WO claimed
EP-0579113-B1 Improved process for preparing cyclic acetals of 3-formyl-2-butenyl-triphenylphosphonium chloride BASF AG (DE) 1997-05-02 EP claimed
US-5344995-A Preparation of cyclic acetals of 3-formyl-2-butenyltriphenylphosphonium chloride BASF AKTIENGESELLSCHAFT (DE) 1994-09-06 US claimed
EP-0008581-A1 METHOD OF PREPARING E-4-ACETOXY-2-METHYL-2-BUTENAL BABLER, James, H. (US) 1980-03-05 EP claimed
US-4175204-A Method of preparing E-4-acetoxy-2-methyl-2-butenal BABLER JAMES H 1979-11-20 US claimed
WO-1979000485-A1 METHOD OF PREPARING E-4-ACETOXY-2-METHYL-2-BUTENAL BABLER J 1979-07-26 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250083137-A1 SUPPORTED HYDROFORMYLATION CATALYST AND PREPARATION METHOD THEREOF, AND METHOD FOR SYNTHESIZING 4-ACETYLOXY-2-METHYL-2-BUTENAL NQO1, PNN, HPGD ALDH1A1 72/4885ALOX15 128/4885HSD17B10 248/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.