SCHEMBL3200694

SCHEMBL3200694

O=C(CCc1ccc(O)cc1Cl)CC(=O)CCc1ccc(O)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.49
HSD17B10 Q99714 1/20 0.42
CAMK2A Q9UQM7 1/20 0.41
CHRNA7 P36544 1/20 0.40

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
SCHEMBL14793675 0.84 POLB (0.50) HSD17B10CAMK2A
SCHEMBL28179666 0.82 HSD17B10 (0.42) BACE1HSD17B10CHRNA7
SCHEMBL1744734 0.81 KDM4E (0.43)
SCHEMBL4208352 0.80 TYR (0.58) HSD17B10
SCHEMBL14793793 0.79 F13A1 (0.46) CAMK2A
SCHEMBL20152943 0.78 HSD17B10 (0.45) BACE1HSD17B10CAMK2A
SCHEMBL6165426 0.77 HSD17B10 (0.52) BACE1HSD17B10
SCHEMBL28753564 0.76 HPGD (0.50) BACE1CAMK2A
SCHEMBL14793781 0.76 F13A1 (0.51) CAMK2A
SCHEMBL5990825 0.76 CYP4F2 (0.51) 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 BACE1 1/4885HSD17B10 1270/4885CAMK2A 22/4885

“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.