SCHEMBL3221683

SCHEMBL3221683

O=C(C=Cc1cccc2cc[nH]c12)CC(=O)C=Cc1cccc2cc[nH]c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 5/20 1.00
KEAP1 Q14145 1/20 0.47
PDPK1 O15530 1/20 0.46
NFE2L2 Q16236 2/20 0.44
BCHE P06276 3/20 0.43
AHR P35869 1/20 0.41
PARP1 P09874 1/20 0.40
IAPP P10997 1/20 0.40
NR3C1 P04150 1/20 0.40
PGR P06401 1/20 0.40
NR3C2 P08235 1/20 0.40
AR P10275 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
APP P05067 2/20 0.39
MAPT P10636 2/20 0.39
GRM5 P41594 1/20 0.39

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
SCHEMBL3221662 1.00 BACE1 (1.00) BACE1KEAP1PDPK1NFE2L2BCHE
SCHEMBL1137338 0.85 BACE1 (0.74) BACE1KEAP1PDPK1BCHEAHR
SCHEMBL1137340 0.85 BACE1 (0.74) BACE1KEAP1PDPK1BCHEAHR
SCHEMBL4220788 0.84 BACE1 (0.72) BACE1KEAP1PDPK1BCHEAHR
SCHEMBL3785281 0.84 BACE1 (0.72) BACE1KEAP1PDPK1BCHEAHR
SCHEMBL3785280 0.84 BACE1 (0.72) BACE1KEAP1PDPK1BCHEAHR
SCHEMBL4478979 0.83 BACE1 (0.71) BACE1KEAP1PDPK1NFE2L2BCHE
SCHEMBL4478974 0.83 BACE1 (0.71) BACE1KEAP1PDPK1NFE2L2BCHE
SCHEMBL21274678 0.80 BACE1 (0.67) BACE1KEAP1PDPK1BCHEAHR
SCHEMBL1137814 0.80 BACE1 (0.66) BACE1KEAP1PDPK1BCHEMAPT

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 1/4885KEAP1 115/4885PDPK1 1290/4885

“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.