SCHEMBL3198240

SCHEMBL3198240

COc1cc(C=CC(=O)CC(=O)C=Cc2cn(Cc3ccccc3)c3ccccc23)ccc1O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 7/20 0.70
APP P05067 9/20 0.63
MAPT P10636 9/20 0.63
MEN1 O00255 2/20 0.62
POLB P06746 2/20 0.62
GAA P10253 2/20 0.62
KMT2A Q03164 2/20 0.62
CYP2D6 P10635 2/20 0.60
CYP2C9 P11712 2/20 0.60
TSHR P16473 2/20 0.60
HSD17B10 Q99714 2/20 0.60
ALOX5 P09917 2/20 0.60
HDAC3 O15379 2/20 0.60
HDAC1 Q13547 2/20 0.60
HDAC2 Q92769 2/20 0.60
HDAC6 Q9UBN7 2/20 0.60
CYP2C19 P33261 1/20 0.60
KDM4E B2RXH2 1/20 0.60
PTGES O14684 1/20 0.60
CA12 O43570 1/20 0.60

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
SCHEMBL3198223 1.00 BACE1 (0.70) BACE1APPMAPTMEN1POLB
SCHEMBL3212525 0.92 BACE1 (0.70) BACE1APPMAPTMEN1POLB
SCHEMBL3212508 0.92 BACE1 (0.70) BACE1APPMAPTMEN1POLB
SCHEMBL3221534 0.86 BACE1 (0.69) BACE1APPMAPTMEN1POLB
SCHEMBL3221523 0.86 BACE1 (0.69) BACE1APPMAPTMEN1POLB
SCHEMBL3221709 0.82 BACE1 (1.00) BACE1MAPTMEN1POLBKMT2A
SCHEMBL3221697 0.82 BACE1 (1.00) BACE1MAPTMEN1POLBKMT2A
SCHEMBL3220655 0.82 BACE1 (0.81) BACE1APPMAPTMEN1POLB
SCHEMBL3220639 0.82 BACE1 (0.81) BACE1APPMAPTMEN1POLB
SCHEMBL3198163 0.82 BACE1 (0.73) BACE1APPMAPTMEN1POLB

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.