SCHEMBL3209446

SCHEMBL3209446

O=C(/C=C/c1cc2ccccc2o1)CC(=O)/C=C/c1cc2ccccc2o1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.62
MAPK1 P28482 3/20 0.62
NPC1 O15118 3/20 0.62
MAPT P10636 2/20 0.62
CYP2A6 P11509 1/20 0.56
PLIN1 O60240 1/20 0.52
LMNA P02545 1/20 0.52
GAA P10253 1/20 0.52
PLIN5 Q00G26 1/20 0.52
ABHD5 Q8WTS1 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
MAOB P27338 2/20 0.49
FLT3 P36888 1/20 0.47
APP P05067 1/20 0.47
TP53 P04637 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44

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
SCHEMBL3209460 1.00 RAB9A (0.62) RAB9AMAPK1NPC1MAPTCYP2A6
SCHEMBL3218031 0.89 AKR1B10 (0.58) RAB9AMAPK1NPC1MAPTMAOB
SCHEMBL3218041 0.89 AKR1B10 (0.58) RAB9AMAPK1NPC1MAPTMAOB
SCHEMBL29871432 0.85 MAPT (0.64) RAB9AMAPK1NPC1MAPTCYP2A6
SCHEMBL1226012 0.85 MAPT (0.64) RAB9AMAPK1NPC1MAPTCYP2A6
SCHEMBL1226009 0.85 MAPT (0.64) RAB9AMAPK1NPC1MAPTCYP2A6
SCHEMBL10105406 0.84 MAPK1 (0.56) RAB9AMAPK1NPC1MAPTCYP2A6
SCHEMBL10554653 0.84 RAB9A (0.59) RAB9AMAPK1NPC1MAPTCYP2A6
SCHEMBL9799652 0.83 MAPT (0.62) RAB9AMAPK1NPC1MAPTCYP2A6
SCHEMBL30963012 0.83 MAPT (0.62) RAB9AMAPK1NPC1MAPTCYP2A6

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 RAB9A 1684/4885MAPK1 921/4885NPC1 837/4885

“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.