SCHEMBL3216595

SCHEMBL3216595

CN(C)c1ccc(/C=C/C(=O)CC(=O)CCc2ccc(O)cc2)c2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 14/20 0.61
ALOX5 P09917 1/20 0.43
DNTT P04053 1/20 0.41
CAPN1 P07384 1/20 0.39
CTSL P07711 1/20 0.39
CTSB P07858 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
SCHEMBL3216611 1.00 BACE1 (0.61) BACE1ALOX5DNTTCAPN1CTSL
SCHEMBL3217407 0.84 BACE1 (0.69) BACE1
SCHEMBL3217396 0.84 BACE1 (0.69) BACE1
SCHEMBL3222196 0.79 RXRA (0.42) BACE1
SCHEMBL1645750 0.76 BACE1 (1.00) BACE1ALOX5
SCHEMBL1645753 0.76 BACE1 (1.00) BACE1ALOX5
SCHEMBL13746120 0.75 BACE1 (0.61) BACE1ALOX5
SCHEMBL1646989 0.74 BACE1 (0.73) BACE1ALOX5
SCHEMBL1646127 0.74 BACE1 (1.00) BACE1
SCHEMBL1646124 0.74 BACE1 (1.00) BACE1

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 1/4885ALOX5 1890/4885DNTT 3619/4885

“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.