SCHEMBL3204520

SCHEMBL3204520

Cn1c(/C=C/C(=O)CC(=O)/C=C/c2cc3ccccc3n2C)cc2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALB P02768 1/20 0.49
MCL1 Q07820 1/20 0.49
GRIN2D O15399 1/20 0.47
GRIN3B O60391 1/20 0.47
GRIN1 Q05586 1/20 0.47
GRIN2A Q12879 1/20 0.47
GRIN2B Q13224 1/20 0.47
GRIN2C Q14957 1/20 0.47
GRIN3A Q8TCU5 1/20 0.47
DAO P14920 1/20 0.45
POLB P06746 1/20 0.45
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
SLC9A1 P19634 1/20 0.42
AHR P35869 1/20 0.42
MAPT P10636 1/20 0.41

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
SCHEMBL3204531 1.00 ALB (0.49) ALBMCL1GRIN2DGRIN3BGRIN1
SCHEMBL3223018 0.89 AKR1B1 (0.55)
SCHEMBL3223005 0.89 AKR1B1 (0.55)
SCHEMBL29247884 0.86 GRIN2D (0.51) ALBMCL1GRIN2DGRIN3BGRIN1
SCHEMBL7326492 0.86 MCL1 (0.54) ALBMCL1GRIN2DGRIN3BGRIN1
SCHEMBL7326486 0.86 MCL1 (0.54) ALBMCL1GRIN2DGRIN3BGRIN1
SCHEMBL6364609 0.85 ALB (0.47) ALBMCL1GRIN2DGRIN3BGRIN1
SCHEMBL6364611 0.85 ALB (0.47) ALBMCL1GRIN2DGRIN3BGRIN1
SCHEMBL3200599 0.82 APP (0.69) POLBMEN1KMT2AMAPT
SCHEMBL3211696 0.82 MAPT (0.61) POLBMEN1KMT2AMAPT

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 ALB 4033/4885MCL1 2424/4885GRIN2D 44/4885

“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.