SCHEMBL3046003

SCHEMBL3046003

O=C(/C=C/c1ccc(OCc2ccccc2)cc1)c1ccc(OCc2ccccc2)cc1OCc1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.71
SLC5A1 P13866 1/20 0.66
SLC5A2 P31639 1/20 0.66
ABCG2 Q9UNQ0 1/20 0.65
GSK3B P49841 4/20 0.65
BACE1 P56817 4/20 0.65
MAOB P27338 2/20 0.62
MEN1 O00255 3/20 0.61
MAPT P10636 3/20 0.61
KMT2A Q03164 3/20 0.61
KDM4E B2RXH2 2/20 0.61
TP53 P04637 1/20 0.61
NR1I2 O75469 1/20 0.58
LMNA P02545 1/20 0.58
PGR P06401 1/20 0.58
ADRB2 P07550 1/20 0.58
ADRB1 P08588 1/20 0.58
ADORA3 P0DMS8 1/20 0.58
HPGD P15428 1/20 0.58
CNR1 P21554 1/20 0.58

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
SCHEMBL25285074 0.90 APP (0.86) APPSLC5A1SLC5A2ABCG2GSK3B
SCHEMBL20169867 0.90 APP (0.86) APPSLC5A1SLC5A2ABCG2GSK3B
SCHEMBL25196413 0.90 APP (0.86) APPSLC5A1SLC5A2ABCG2GSK3B
SCHEMBL27723382 0.89 APP (0.74) APPABCG2GSK3BBACE1MAOB
SCHEMBL27723380 0.89 APP (0.74) APPABCG2GSK3BBACE1MAOB
SCHEMBL2970084 0.87 APP (0.66) APPABCG2GSK3BMEN1MAPT
SCHEMBL7751094 0.87 HDAC8 (0.62) APPSLC5A1SLC5A2ABCG2MAOB
SCHEMBL7751091 0.87 HDAC8 (0.62) APPSLC5A1SLC5A2ABCG2MAOB
SCHEMBL25199799 0.86 APP (0.80) APPSLC5A1SLC5A2ABCG2GSK3B
SCHEMBL25191246 0.86 APP (0.80) APPSLC5A1SLC5A2ABCG2GSK3B

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 4361/4885SLC5A1 34/4885SLC5A2 35/4885

“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.