SCHEMBL3208961

SCHEMBL3208961

COc1ccc(O)cc1CCC(=O)CC(=O)CCc1cc(O)ccc1OC

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.55
OR51E2 Q9H255 1/20 0.55
TTR P02766 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
BACE1 P56817 1/20 0.48
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
F2RL1 P55085 1/20 0.46
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
HSD17B10 Q99714 1/20 0.45
EGFR P00533 1/20 0.45
APP P05067 1/20 0.44

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
SCHEMBL20152947 0.93 ALOX5 (0.49) ALOX5OR51E2TTRMEN1KMT2A
SCHEMBL5034496 0.87 BACE1 (0.48) TTRMEN1KMT2ABACE1KDM4E
SCHEMBL20152931 0.86 TTR (0.44) ALOX5OR51E2TTRMEN1KMT2A
SCHEMBL20152905 0.85 TTR (0.43) ALOX5OR51E2TTRMEN1KMT2A
SCHEMBL3220836 0.81 MEN1 (0.64) ALOX5OR51E2MEN1KMT2ABACE1
SCHEMBL20152889 0.81 ALOX5 (0.48) ALOX5TTRKDM4EALDH1A1HSD17B10
SCHEMBL6035879 0.80 CYP4F2 (0.50) TTRMEN1KMT2AKDM4EALDH1A1
SCHEMBL178369 0.77 MAOB (0.52) ALOX5TTRMEN1KMT2ABACE1
SCHEMBL6036250 0.77 EGFR (0.55) TTRMEN1KMT2ABACE1KDM4E
SCHEMBL7332981 0.77 HSD17B10 (0.63) HSD17B10

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 ALOX5 1890/4885OR51E2 4367/4885TTR 1425/4885

“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.