SCHEMBL13029337

SCHEMBL13029337

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

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 1/20 0.64
PTPN1 P18031 1/20 0.62
MAOB P27338 3/20 0.61
HDAC8 Q9BY41 1/20 0.61
MEN1 O00255 1/20 0.59
POLB P06746 1/20 0.59
PKM P14618 1/20 0.59
BLM P54132 1/20 0.59
KMT2A Q03164 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
NPC1 O15118 1/20 0.56
ALDH1A1 P00352 1/20 0.56
MAPT P10636 1/20 0.56
RAB9A P51151 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
PTGS1 P23219 2/20 0.56
PTGS2 P35354 2/20 0.56
SLC5A1 P13866 1/20 0.55
SLC5A2 P31639 1/20 0.55
PARP10 Q53GL7 1/20 0.55

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
SCHEMBL3046006 1.00 ABCG2 (0.64) ABCG2PTPN1MAOBHDAC8MEN1
SCHEMBL30066572 0.93 MAOB (0.69) ABCG2PTPN1MAOBHDAC8MEN1
SCHEMBL30066569 0.93 MAOB (0.69) ABCG2PTPN1MAOBHDAC8MEN1
SCHEMBL27799480 0.89 HDAC8 (0.73) ABCG2PTPN1MAOBHDAC8MEN1
SCHEMBL27799479 0.89 HDAC8 (0.73) ABCG2PTPN1MAOBHDAC8MEN1
SCHEMBL7751094 0.89 HDAC8 (0.62) ABCG2PTPN1MAOBHDAC8MEN1
SCHEMBL7751091 0.89 HDAC8 (0.62) ABCG2PTPN1MAOBHDAC8MEN1
SCHEMBL5132842 0.88 MAPT (0.75) ABCG2PTPN1MAOBHDAC8MEN1
SCHEMBL2970085 0.88 HDAC8 (0.62) ABCG2PTPN1MAOBHDAC8MEN1
SCHEMBL13029333 0.88 HDAC8 (0.62) ABCG2PTPN1MAOBHDAC8MEN1

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 4 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
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 ABCG2 432/4885PTPN1 2982/4885MAOB 2412/4885

“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.