SCHEMBL3222998

SCHEMBL3222998

CCN(CC)c1ccc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(OC)c2)c(OCc2ccccc2)c1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 11/20 0.80
APP P05067 7/20 0.60
MAPT P10636 7/20 0.60
FGFR1 P11362 1/20 0.57
MMP9 P14780 2/20 0.56
CYP2D6 P10635 2/20 0.55
CYP2C9 P11712 2/20 0.55
TSHR P16473 2/20 0.55
HSD17B10 Q99714 2/20 0.55
CA12 O43570 2/20 0.55
CA4 P22748 2/20 0.55
CA6 P23280 2/20 0.55
CA5A P35218 2/20 0.55
CA7 P43166 2/20 0.55
CA9 Q16790 2/20 0.55
CA14 Q9ULX7 2/20 0.55
CA5B Q9Y2D0 2/20 0.55
ABCB1 P08183 2/20 0.55
AKR1B1 P15121 2/20 0.55
MAOA P21397 2/20 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
SCHEMBL3222986 1.00 BACE1 (0.80) BACE1APPMAPTFGFR1MMP9
SCHEMBL3208390 0.93 BACE1 (0.80) BACE1APPMAPTMAOAMAOB
SCHEMBL3208402 0.93 BACE1 (0.80) BACE1APPMAPTMAOAMAOB
SCHEMBL3211720 0.89 BACE1 (1.00) BACE1APPMAPTGSK3BHDAC8
SCHEMBL3211707 0.89 BACE1 (1.00) BACE1APPMAPTGSK3BHDAC8
SCHEMBL3218717 0.88 BACE1 (0.86) BACE1APPMAPTKDM4EALDH1A1
SCHEMBL3218705 0.88 BACE1 (0.86) BACE1APPMAPTKDM4EALDH1A1
SCHEMBL3214640 0.87 BACE1 (0.79) BACE1APPMAPTFGFR1MMP9
SCHEMBL3214647 0.87 BACE1 (0.79) BACE1APPMAPTFGFR1MMP9
SCHEMBL3218677 0.85 BACE1 (0.79) BACE1APPMAPTFGFR1MMP9

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 1/4885APP 2/4885MAPT 8/4885

“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.