SCHEMBL3218660

SCHEMBL3218660

CS(=O)(=O)c1ccc(/C=C/C(=O)CC(=O)/C=C/c2ccc(O)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 3/20 0.71
▸ AKR1B1 P15121 2/20 0.71
▸ PTGS2 P35354 2/20 0.71
▸ AKR1B10 O60218 1/20 0.71
▸ GLO1 Q04760 1/20 0.71
▸ CAMK2A Q9UQM7 1/20 0.71
▸ BACE1 P56817 13/20 0.60
▸ ENPP2 Q13822 1/20 0.58
▸ ABCB1 P08183 1/20 0.54
▸ MAOA P21397 1/20 0.54
▸ CA12 O43570 1/20 0.51
▸ CA1 P00915 1/20 0.51
▸ CA2 P00918 1/20 0.51
▸ TYR P14679 1/20 0.51
▸ CA7 P43166 1/20 0.51
▸ CA9 Q16790 1/20 0.51
▸ CA14 Q9ULX7 1/20 0.51

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
SCHEMBL3218671 1.00 MAOB (0.71) MAOBAKR1B1PTGS2AKR1B10GLO1
SCHEMBL9189840 0.84 ENPP2 (0.75) MAOBAKR1B1PTGS2ENPP2ABCB1
Bisdemethoxycurcumin SCHEMBL428638 0.84 AKR1B1 (1.00) MAOBAKR1B1PTGS2AKR1B10GLO1
Bisdemethoxycurcumin SCHEMBL2574140 0.84 AKR1B1 (1.00) MAOBAKR1B1PTGS2AKR1B10GLO1
SCHEMBL25190877 0.84 MAOB (0.75) MAOBPTGS2MAOA
Bisdemethoxycurcumin SCHEMBL28163045 0.82 AKR1B1 (0.96) MAOBAKR1B1PTGS2AKR1B10GLO1
SCHEMBL3215468 0.80 APP (0.78) MAOBAKR1B1PTGS2GLO1CAMK2A
SCHEMBL3215485 0.80 APP (0.78) MAOBAKR1B1PTGS2GLO1CAMK2A
SCHEMBL10005951 0.80 MAOB (0.81) MAOBAKR1B1PTGS2AKR1B10GLO1
SCHEMBL1646481 0.80 AKR1B1 (0.81) MAOBAKR1B1PTGS2AKR1B10GLO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8962674-B2 Curcumin derivative TOKYO INSTITUTE OF TECHNOLOGY (JP) 2015-02-24 — — US disclosed
US-20100048901-A1 NOVEL CURCUMIN DERIVATIVE TOKYO INSTITUTE OF TECHNOLOGY (JP) 2010-02-25 — — US disclosed
EP-2123637-A1 NOVEL CURCUMIN DERIVATIVE Tokyo Institute of Technology (JP) 2009-11-25 — — 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 (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-20100048901-A1 NOVEL CURCUMIN DERIVATIVE BACE1, APP, BACE2 MAOB 969/4885AKR1B1 1096/4885PTGS2 1089/4885

“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.

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