SCHEMBL1647249

SCHEMBL1647249

CN(C)c1ccc(/C=C/C(=O)CC(=O)/C=C/c2ccc(N(C)C)cc2Cl)c(Cl)c1

nearest known ligand 0.80

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 14/20 0.80
NPC1 O15118 2/20 0.50
ALDH1A1 P00352 2/20 0.50
MAPT P10636 2/20 0.50
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
PTGS2 P35354 1/20 0.50
MEN1 O00255 1/20 0.50
TP53 P04637 1/20 0.50
KMT2A Q03164 1/20 0.50
POLB P06746 1/20 0.48
SLC2A1 P11166 1/20 0.47
MMP8 P22894 1/20 0.47

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
SCHEMBL1647252 1.00 BACE1 (0.80) BACE1NPC1ALDH1A1MAPTRAB9A
SCHEMBL1647372 0.89 BACE1 (1.00) BACE1PTGS2
SCHEMBL1647373 0.89 BACE1 (1.00) BACE1PTGS2
SCHEMBL1646897 0.86 BACE1 (0.73) BACE1
SCHEMBL1646898 0.86 BACE1 (0.73) BACE1
SCHEMBL4280610 0.86 BACE1 (0.61) BACE1NPC1ALDH1A1MAPTRAB9A
SCHEMBL4280612 0.86 BACE1 (0.61) BACE1NPC1ALDH1A1MAPTRAB9A
SCHEMBL1648154 0.85 BACE1 (0.72) BACE1MAPT
SCHEMBL1648152 0.85 BACE1 (0.72) BACE1MAPT
SCHEMBL1645753 0.83 BACE1 (1.00) BACE1MMP8

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 5 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-8552220-B2 Therapeutic agent for Alzheimer's disease TOKYO INSTITUTE OF TECHNOLOGY (JP) 2013-10-08 US disclosed
EP-2305629-A1 THERAPEUTIC AGENT FOR ALZHEIMER'S DISEASE Tokyo Institute of Technology (JP) 2011-04-06 EP 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 1/4885NPC1 837/4885ALDH1A1 253/4885

“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.