SCHEMBL3485127

SCHEMBL3485127

C=C(C=O)Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.50
CES2 O00748 1/20 0.50
AKR1B1 P15121 1/20 0.50
PAM P19021 2/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
CTBP2 P56545 1/20 0.41
EPHX2 P34913 1/20 0.41
ADH1B P00325 1/20 0.40
ADH1C P00326 1/20 0.40
ADH1A P07327 1/20 0.40

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
SCHEMBL1073587 0.79 CES1 (0.46) CES1CES2AKR1B1MEN1KMT2A
Benzene SCHEMBL28149238 0.79 CES1 (0.46) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL9516170 0.78 TGM2 (0.42) MEN1KMT2AL3MBTL1LMNAGAA
SCHEMBL9513630 0.78 ALDH1A1 (0.42) CYP2C9ALDH1A1LMNAMAPT
SCHEMBL7557513 0.78 KEAP1 (0.54) MEN1KMT2AHDAC8HDAC6L3MBTL1
SCHEMBL1593360 0.78 SMN1; SMN2 (0.47) KMT2AALDH1A1CTBP2LMNAGAA
SCHEMBL9515104 0.78 CTBP2 (0.43) MEN1KMT2AL3MBTL1ALDH1A1CTBP2
SCHEMBL9513564 0.78 PIK3CA (0.44) MEN1KMT2ACYP3A4L3MBTL1ALDH1A1
SCHEMBL13017152 0.77 CES1 (0.44) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL11058375 0.77 CES1 (0.40) CES1CES2AKR1B1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118772412-A Aldehyde modified silicone oil, preparation method and application 山东共聚有机硅技术研究院有限公司 2024-10-15 CN claimed
WO-2024044679-A2 METHODS OF SYNTHESIZING PEPTIDES WITH FREE N-TERMINAL CYSTEINE AND PRODUCTS THEREOF OHIO STATE INNOVATION FOUNDATION (US) 2024-02-29 WO claimed
CN-112574016-B Method for synthesizing alpha-methyl cinnamaldehyde from phenylpropyl aldehyde 万华化学集团股份有限公司 2022-09-20 CN claimed
CN-112574016-A Method for synthesizing alpha-methyl cinnamaldehyde from phenylpropyl aldehyde 万华化学集团股份有限公司 2021-03-30 CN claimed
US-4677230-A ISOMERIZATION USING RARE EARTH METAL, PALLADIUM CATALYST BASF AKTIENGESELLSCHAFT (DE) 1987-06-30 US claimed
US-12454502-B2 Synthesis of deuterated aldehydes ARIZONA BOARD OF REGENTS ON BEHALF OF ATHE UNIVERSITY OF ARIZONA (US) 2025-10-28 US disclosed
CN-118772412-A Aldehyde modified silicone oil, preparation method and application 山东共聚有机硅技术研究院有限公司 2024-10-15 CN disclosed
WO-2024044679-A2 METHODS OF SYNTHESIZING PEPTIDES WITH FREE N-TERMINAL CYSTEINE AND PRODUCTS THEREOF OHIO STATE INNOVATION FOUNDATION (US) 2024-02-29 WO disclosed
WO-2023115291-A1 PROCESS FOR PRODUCING α, β-UNSATURATED ALDEHYDE COMPOUNDS RHODIA OPERATIONS (FR) 2023-06-29 WO disclosed
WO-2023115291-A1 PROCESS FOR PRODUCING α, β-UNSATURATED ALDEHYDE COMPOUNDS RHODIA OPERATIONS (FR) 2023-06-29 WO disclosed
US-20220356139-A1 SYNTHESIS OF DEUTERATED ALDEHYDES ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2022-11-10 US disclosed
CN-112574016-B Method for synthesizing alpha-methyl cinnamaldehyde from phenylpropyl aldehyde 万华化学集团股份有限公司 2022-09-20 CN disclosed
EP-0233154-A2 Unsaturated amino-acids CIBA-GEIGY AG (CH) 1987-08-19 EP disclosed
US-4677230-A ISOMERIZATION USING RARE EARTH METAL, PALLADIUM CATALYST BASF AKTIENGESELLSCHAFT (DE) 1987-06-30 US disclosed
US-4672137-A Preparation of 1,3-di(alkoxycarbonylamino)propanes BASF AKTIENGESELLSCHAFT (DE) 1987-06-09 US disclosed
EP-0211205-A2 Process for the preparation of 2-methyl-2-alkenals BASF Aktiengesellschaft (DE) 1987-02-25 EP disclosed
EP-0167021-B1 PROCESS FOR THE PREPARATION OF 2-METHYL-2-ALKENALS BASF Aktiengesellschaft (DE) 1986-12-30 EP disclosed
EP-0202523-A2 Process for the preparation of 1,3-di(alkoxycarbonylamino) propane BASF Aktiengesellschaft (DE) 1986-11-26 EP disclosed
US-4599458-A CATALYTIC ISOMERIZATION OF ACROLEIN DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 1986-07-08 US disclosed
EP-0167021-A1 Process for the preparation of 2-methyl-2-alkenals BASF Aktiengesellschaft (DE) 1986-01-08 EP disclosed

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

For each of this compound's patents that has machine-readable text (2 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-12454502-B2 Synthesis of deuterated aldehydes ADH1C, ADH1A, CBR1 CES1 441/4885CES2 394/4885AKR1B1 233/4885
US-20220356139-A1 SYNTHESIS OF DEUTERATED ALDEHYDES ADH1C, ADH1A, CBR1 CES1 441/4885CES2 394/4885AKR1B1 233/4885

“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.