SCHEMBL3213822

SCHEMBL3213822

O=C(/C=C/c1cccc(Oc2ccccc2)c1)CC(=O)/C=C/c1cccc(Oc2ccccc2)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.72
ALOX5 P09917 3/20 0.65
PTGS1 P23219 2/20 0.65
PTGS2 P35354 2/20 0.65
EPOR P19235 4/20 0.59
MEN1 O00255 1/20 0.58
NPC1 O15118 1/20 0.58
POLB P06746 1/20 0.58
RAB9A P51151 1/20 0.58
KMT2A Q03164 1/20 0.58
KDM5A P29375 1/20 0.57
ALOX5AP P20292 1/20 0.57
HAO1 Q9UJM8 1/20 0.56
MAPT P10636 2/20 0.55
TLR4 O00206 1/20 0.55
TLR2 O60603 1/20 0.55
KDM4E B2RXH2 2/20 0.55
ALDH1A1 P00352 2/20 0.55
PKM P14618 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL3213833 1.00 BACE1 (0.72) BACE1ALOX5PTGS1PTGS2EPOR
SCHEMBL10349069 0.95 BACE1 (0.67) BACE1ALOX5PTGS1PTGS2EPOR
SCHEMBL10349067 0.95 BACE1 (0.67) BACE1ALOX5PTGS1PTGS2EPOR
SCHEMBL3214950 0.92 BACE1 (0.70) BACE1ALOX5PTGS1PTGS2EPOR
SCHEMBL3214959 0.92 BACE1 (0.70) BACE1ALOX5PTGS1PTGS2EPOR
SCHEMBL10348278 0.89 BACE1 (0.64) BACE1ALOX5PTGS1PTGS2EPOR
SCHEMBL10348279 0.89 BACE1 (0.64) BACE1ALOX5PTGS1PTGS2EPOR
SCHEMBL7332640 0.87 ALOX5 (0.68) BACE1ALOX5PTGS1PTGS2EPOR
SCHEMBL8494290 0.87 ALOX5 (0.68) BACE1ALOX5PTGS1PTGS2EPOR
SCHEMBL1206897 0.87 ALOX5 (0.68) BACE1ALOX5PTGS1PTGS2EPOR

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 BACE1 1/4885ALOX5 1890/4885PTGS1 563/4885

“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.