SCHEMBL4544305

SCHEMBL4544305

O=C(/C=C(O)/C=C/c1ccc(O)cc1)/C=C/c1ccc(O)c(CO)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 12/20 0.68
GSK3B P49841 9/20 0.68
TLR9 Q9NR96 1/20 0.68
TYR P14679 2/20 0.50
MMP2 P08253 2/20 0.50
MMP9 P14780 2/20 0.50
MMP8 P22894 2/20 0.50
NFKB1 P19838 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
F3 P13726 1/20 0.50
HSD11B1 P28845 1/20 0.50
FOS P01100 1/20 0.50
JUN P05412 1/20 0.50
HDAC1 Q13547 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
AKR1B10 O60218 2/20 0.45
AKR1B1 P15121 2/20 0.45
CA12 O43570 1/20 0.45

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
SCHEMBL12291332 0.90 FOS (0.67) BACE1GSK3BTLR9MMP2MMP9
SCHEMBL15249303 0.88 MMP2 (0.51) BACE1GSK3BTLR9MMP2MMP9
SCHEMBL12291330 0.87 BACE1 (0.53) BACE1GSK3BTLR9MMP2MMP9
SCHEMBL13358511 0.86 GSK3B (0.69) BACE1GSK3BTLR9MMP2MMP9
SCHEMBL17691402 0.86 MMP2 (0.52) BACE1GSK3BTLR9MMP2MMP9
SCHEMBL26555396 0.86 BACE1 (0.48) BACE1GSK3BTLR9MMP2MMP9
SCHEMBL4544307 0.84 MMP2 (0.74) BACE1GSK3BTLR9TYRMMP2
SCHEMBL13446382 0.84 MMP2 (0.74) BACE1GSK3BTLR9TYRMMP2
SCHEMBL11928819 0.84 MMP2 (0.74) BACE1GSK3BTLR9TYRMMP2
SCHEMBL15042796 0.83 MMP2 (0.55) BACE1GSK3BTLR9MMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11839637-B2 Neuron activator KINJIRUSHI CO., LTD. (JP) 2023-12-12 US disclosed
US-20230190856-A1 COMPOSITION COMPRISING A COMPLEX COMPRISING A CURCUMINOID COMPOUND, AND STEVIOL GLYCOSIDES OR A LICORICE EXTRACT OR A FRACTION THEREOF, AND USES THEREOF KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2023-06-22 US disclosed
US-20140248382-A1 CURCUMINOID-BASED COMPOUND/STEVIOSIDE-CONTAINING COMPLEX FOR THE PREVENTION AND TREATMENT OF AN INFLUENZA VIRUS INFECTION KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2014-09-04 US disclosed
US-8545903-B2 Composition for the prevention and treatment of influenza virus infection and composition for suppressing neuraminidase activity comprising turmeric extract KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2013-10-01 US disclosed
US-20120107429-A1 Composition For The Prevention And Treatment Of Influenza Virus Infection And Composition For Suppressing Neuraminidase Activity Comprising Turmeric Extract BIOTEN CO., LTD. (KR) 2012-05-03 US disclosed
EP-1494993-B1 NOVEL CURCUMIN ANALOGUES AND USES THEREOF UNIV NORTH CAROLINA (US) 2010-05-05 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 (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-20230190856-A1 COMPOSITION COMPRISING A COMPLEX COMPRISING A CURCUMINOID COMPOUND, AND STEVIOL GLYCOSIDES OR A LICORICE EXTRACT OR A FRACTION THEREOF, AND USES THEREOF CD4, IFNG, CD14 BACE1 1151/4885GSK3B 1132/4885TLR9 177/4885
US-20140248382-A1 CURCUMINOID-BASED COMPOUND/STEVIOSIDE-CONTAINING COMPLEX FOR THE PREVENTION AND TREATMENT OF AN INFLUENZA VIRUS INFECTION VIP, CRY1, MAVS BACE1 83/4885GSK3B 1759/4885TLR9 1604/4885
US-20120107429-A1 Composition For The Prevention And Treatment Of Influenza Virus Infection And Composition For Suppressing Neuraminidase Activity Comprising Turmeric Extract NEU1, NEU3, NEU4 BACE1 88/4885GSK3B 1413/4885TLR9 3152/4885
US-11839637-B2 Neuron activator BDNF, DBH, CHAT BACE1 92/4885GSK3B 2892/4885TLR9 2925/4885

“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.