Cinnamaldehyde

Cinnamaldehyde

SCHEMBL29029047

CCO.CCO.O=CC=Cc1ccccc1

nearest known ligand 0.75

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Known targets — ChEMBL curated mechanism

MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Cinnamaldehyde. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.75
LMNA P02545 3/20 0.75
TRPA1 O75762 1/20 0.75
ALOX5 P09917 1/20 0.75
MAPK1 P28482 1/20 0.75
MAOB P27338 1/20 0.52
MAPT P10636 2/20 0.52
KDM4E B2RXH2 1/20 0.52
CDK4 P11802 5/20 0.50
CCND1 P24385 5/20 0.50
CCNB2 O95067 4/20 0.50
CDK1 P06493 4/20 0.50
CCNB1 P14635 4/20 0.50
CCNB3 Q8WWL7 4/20 0.50
NPC1 O15118 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
GLA P06280 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
HDAC3 O15379 2/20 0.44
HDAC4 P56524 2/20 0.44

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
Cinnamaldehyde SCHEMBL6061954 1.00 ALDH1A1 (0.75) ALDH1A1LMNATRPA1ALOX5MAPK1
Cinnamaldehyde SCHEMBL26923210 1.00 ALDH1A1 (0.75) ALDH1A1LMNATRPA1ALOX5MAPK1
Cinnamic Aldehyde SCHEMBL3340838 1.00 ALDH1A1 (0.75) ALDH1A1LMNATRPA1ALOX5MAPK1
Cinnamaldehyde SCHEMBL28719829 0.92 LMNA (0.69) ALDH1A1LMNATRPA1ALOX5MAPK1
Cinnamaldehyde SCHEMBL28719830 0.92 LMNA (0.69) ALDH1A1LMNATRPA1ALOX5MAPK1
Cinnamaldehyde SCHEMBL22729219 0.89 ALDH1A1 (0.78) ALDH1A1LMNATRPA1ALOX5MAPK1
Cinnamaldehyde SCHEMBL22729220 0.89 ALDH1A1 (0.78) ALDH1A1LMNATRPA1ALOX5MAPK1
Cinnamic Aldehyde SCHEMBL22729218 0.89 ALDH1A1 (0.78) ALDH1A1LMNATRPA1ALOX5MAPK1
Cinnamaldehyde SCHEMBL29206157 0.89 ALDH1A1 (0.86) ALDH1A1LMNATRPA1ALOX5MAPK1
Cinnamaldehyde SCHEMBL29206156 0.89 ALDH1A1 (0.86) ALDH1A1LMNATRPA1ALOX5MAPK1

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-116138307-B Controlled-release green fruit and vegetable preservative material and preparation method and application thereof 广东省农业科学院蚕业与农产品加工研究所 2024-03-19 CN disclosed
CN-116138307-A Controlled-release green fruit and vegetable preservative material and preparation method and application thereof 广东省农业科学院蚕业与农产品加工研究所 2023-05-23 CN disclosed