Caffeic Acid

Caffeic Acid

SCHEMBL1172850

O.O=C(O)/C=C/c1ccc(O)c(O)c1

nearest known ligand 0.96

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO

The experimentally established mechanism targets of Caffeic Acid. 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
DPP4 known ✓ P27487 2/20 0.96
MMP1 known ✓ P03956 2/20 0.96
MEN1 known ✓ O00255 1/20 0.96
HDAC3 known ✓ O15379 1/20 0.96
ALOX5 known ✓ P09917 1/20 0.96
THRB known ✓ P10828 1/20 0.96
AGTR1 known ✓ P30556 1/20 0.96
HDAC4 known ✓ P56524 1/20 0.96
HDAC1 known ✓ Q13547 1/20 0.96
HDAC7 known ✓ Q8WUI4 1/20 0.96
HDAC2 known ✓ Q92769 1/20 0.96
HDAC10 known ✓ Q969S8 1/20 0.96
HDAC11 known ✓ Q96DB2 1/20 0.96
HDAC8 known ✓ Q9BY41 1/20 0.96
HDAC6 known ✓ Q9UBN7 1/20 0.96
HDAC9 known ✓ Q9UKV0 1/20 0.96
HDAC5 known ✓ Q9UQL6 1/20 0.96
PTGS1 known ✓ P23219 1/20 0.67
ESR1 known ✓ P03372 1/20 0.59
ESR2 known ✓ Q92731 1/20 0.59

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
Caffeic Acid SCHEMBL1172851 1.00 KDM4E (0.96) KDM4EHSD17B10CA12CA1CA2
Caffeic Acid SCHEMBL29353048 0.98 KDM4E (1.00) KDM4EHSD17B10CA12CA1CA2
Caffeic Acid SCHEMBL30501140 0.98 KDM4E (1.00) KDM4EHSD17B10CA12CA1CA2
Caffeic Acid SCHEMBL30050844 0.98 KDM4E (1.00) KDM4EHSD17B10CA12CA1CA2
Caffeic Acid SCHEMBL1262229 0.98 KDM4E (1.00) KDM4EHSD17B10CA12CA1CA2
Caffeic Acid SCHEMBL7064846 0.98 KDM4E (1.00) KDM4EHSD17B10CA12CA1CA2
Caffeic Acid SCHEMBL23358 0.98 KDM4E (1.00) KDM4EHSD17B10CA12CA1CA2
Caffeic Acid SCHEMBL3682144 0.98 KDM4E (1.00) KDM4EHSD17B10CA12CA1CA2
Caffeic Acid SCHEMBL21114743 0.98 KDM4E (1.00) KDM4EHSD17B10CA12CA1CA2
Caffeic Acid SCHEMBL29447135 0.98 KDM4E (1.00) KDM4EHSD17B10CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11844820-B2 Topical formulation and uses thereof ARTHRITIS RELIEF PLUS LTD. (AU) 2023-12-19 US disclosed
US-20190255133-A1 TOPICAL FORMULATION AND USES THEREOF ARTHRITIS RELIEF PLUS LTD. (AU) 2019-08-22 US disclosed
US-10322155-B2 Topical formulation and uses thereof ARTHRITIS RELIEF PLUS LTD. (AU) 2019-06-18 US disclosed
EP-3284470-A1 TOPICAL FORMULATION COMPRISING COMFREY EXTRACT Arthritis Relief Plus Ltd. (AU) 2018-02-21 EP disclosed
US-20110038965-A1 TOPICAL FORMULATION AND USES THEREOF ARTHRITIS RELIEF PLUS LTD. (AU) 2011-02-17 US disclosed
EP-2086561-A1 TOPICAL FORMULATION AND USES THEREOF Arthritis Relief Plus Ltd. (AU) 2009-08-12 EP disclosed
WO-2008058333-A1 TOPICAL FORMULATION AND USES THEREOF ARTHRITIS RELIEF PLUS LTD (AU) 2008-05-22 WO 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 (4 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-11844820-B2 Topical formulation and uses thereof SYMPK, MMP13, MMP7 DPP4 2561/4885MMP1 23/4885MEN1 1977/4885
US-20190255133-A1 TOPICAL FORMULATION AND USES THEREOF SYMPK, MMP13, MMP7 DPP4 2561/4885MMP1 23/4885MEN1 1977/4885
US-10322155-B2 Topical formulation and uses thereof SYMPK, MMP13, MMP7 DPP4 2568/4885MMP1 28/4885MEN1 2227/4885
US-20110038965-A1 TOPICAL FORMULATION AND USES THEREOF SYMPK, MMP13, MMP7 DPP4 2561/4885MMP1 23/4885MEN1 1977/4885

“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.