SCHEMBL3209529

SCHEMBL3209529

O=C(/C=C/c1ccc2c(c1)OCCO2)CC(=O)/C=C/c1ccc2c(c1)OCCO2

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.73
▸ MAPT P10636 7/20 0.64
▸ RAB9A P51151 6/20 0.64
▸ NPC1 O15118 4/20 0.64
▸ NPSR1 Q6W5P4 1/20 0.62
▸ CXCL12 P48061 1/20 0.61
▸ APP P05067 1/20 0.60
▸ ALDH1A1 P00352 2/20 0.57
▸ TRPV1 Q8NER1 5/20 0.57
▸ KMT2A Q03164 3/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ POLB P06746 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ MAPK1 P28482 1/20 0.56
▸ HTT P42858 1/20 0.56
▸ HCAR2 Q8TDS4 1/20 0.55

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
SCHEMBL3209559 1.00 KDM4E (0.73) KDM4EMAPTRAB9ANPC1NPSR1
SCHEMBL3210767 0.93 MAPT (0.71) KDM4EMAPTRAB9ANPC1NPSR1
SCHEMBL3210786 0.93 MAPT (0.71) KDM4EMAPTRAB9ANPC1NPSR1
SCHEMBL17003817 0.93 KDM4E (0.64) KDM4EMAPTRAB9ANPC1NPSR1
SCHEMBL16485478 0.93 KDM4E (0.64) KDM4EMAPTRAB9ANPC1NPSR1
SCHEMBL17691541 0.90 MAPT (0.71) KDM4EMAPTRAB9ANPC1APP
SCHEMBL2730201 0.85 KDM4E (1.00) KDM4EMAPTRAB9ANPC1NPSR1
SCHEMBL2730205 0.85 KDM4E (1.00) KDM4EMAPTRAB9ANPC1NPSR1
SCHEMBL3211828 0.84 MAPT (0.71) KDM4EMAPTRAB9ANPSR1APP
SCHEMBL3211852 0.84 MAPT (0.71) KDM4EMAPTRAB9ANPSR1APP

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 KDM4E 1141/4885MAPT 8/4885RAB9A 1684/4885

“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.

Send feedback