SCHEMBL2970084

SCHEMBL2970084

COc1cc(/C=C/C(=O)c2ccc(OCc3ccccc3)cc2OCc2ccccc2)ccc1OCc1ccccc1

nearest known ligand 0.90

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
APP P05067 8/20 0.66
GSK3B P49841 1/20 0.64
ABCG2 Q9UNQ0 1/20 0.64
PDE4A P27815 1/20 0.63
PDE4B Q07343 1/20 0.63
PDE4C Q08493 1/20 0.63
PDE4D Q08499 1/20 0.63
ALDH1A1 P00352 2/20 0.62
HPGD P15428 2/20 0.62
ALOX5 P09917 1/20 0.62
HTT P42858 1/20 0.62
KDM4E B2RXH2 1/20 0.62
MEN1 O00255 1/20 0.59
NPC1 O15118 1/20 0.59
MAPT P10636 1/20 0.59
RAB9A P51151 1/20 0.59
KMT2A Q03164 1/20 0.59
ABCB1 P08183 1/20 0.59
ABCC1 P33527 1/20 0.59

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
SCHEMBL25022833 0.90 APP (0.77) APPGSK3BABCG2PDE4APDE4B
SCHEMBL30383144 0.90 APP (0.77) APPGSK3BABCG2PDE4APDE4B
SCHEMBL25265332 0.89 APP (0.78) APPABCG2ALDH1A1HPGDMEN1
SCHEMBL25184980 0.89 APP (0.78) APPABCG2ALDH1A1HPGDMEN1
SCHEMBL30384048 0.89 APP (0.78) APPABCG2ALDH1A1HPGDMEN1
SCHEMBL27723382 0.89 APP (0.74) APPGSK3BABCG2MEN1NPC1
SCHEMBL27723380 0.89 APP (0.74) APPGSK3BABCG2MEN1NPC1
SCHEMBL29137574 0.88 APP (0.61) APPGSK3BPDE4APDE4BPDE4C
SCHEMBL3046003 0.87 APP (0.71) APPGSK3BABCG2ALDH1A1HPGD
SCHEMBL25195540 0.86 APP (0.67) APPGSK3BABCG2ALDH1A1HPGD

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
EP-2253226-B1 Use of hydroxyflavone derivatives for modifying taste LEIBNIZ INST FÜR PFLANZENBIOCHEMIE IPB (DE) 2015-07-15 EP disclosed
EP-2253226-A1 Use of hydroxyflavone derivatives for modifying taste Leibniz-Institut für Pflanzenbiochemie (IPB) (DE) 2010-11-24 EP disclosed
US-20100292175-A1 USE OF HYDROXYFLAVAN DERIVATIVES FOR TASTE MODIFICATION Leibniz-Institut fur Pflanzenbiochemie (DE) 2010-11-18 US 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-20100292175-A1 USE OF HYDROXYFLAVAN DERIVATIVES FOR TASTE MODIFICATION TAS2R50, TAS2R60, TAS2R30 APP 4361/4885GSK3B 4672/4885ABCG2 432/4885

“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.