SCHEMBL998425

SCHEMBL998425

COc1ccc(C=O)cc1OC1CCCCO1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 7/20 0.59
ALDH1A1 P00352 4/20 0.54
TSHR P16473 1/20 0.54
PDE4D Q08499 1/20 0.45
FDPS P14324 1/20 0.44
PTPN1 P18031 2/20 0.44
ALDH1A3 P47895 1/20 0.44
AOX1 Q06278 1/20 0.43
TRIM24 O15164 1/20 0.43
HPGD P15428 1/20 0.43
ALDH5A1 P51649 1/20 0.43
ABAT P80404 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
TRIM33 Q9UPN9 1/20 0.43
TTR P02766 1/20 0.42

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
SCHEMBL3594038 0.96 PDE4B (0.64) PDE4BALDH1A1TSHRPDE4DFDPS
SCHEMBL667201 0.95 ALDH1A1 (0.54) PDE4BALDH1A1TSHRFDPSPTPN1
SCHEMBL3359792 0.92 PDE4B (0.49) PDE4BALDH1A1TSHRPDE4DFDPS
SCHEMBL5863923 0.85 PDE4B (0.47) PDE4BALDH1A1TSHRPTPN1ALDH1A3
SCHEMBL3362581 0.84 PDE4B (0.45) PDE4BALDH1A1TSHRPTPN1ALDH1A3
SCHEMBL3362970 0.83 PDE4B (0.42) PDE4BALDH1A1PTPN1ALDH1A3HPGD
SCHEMBL10080332 0.83 PDE4B (0.42) PDE4BALDH1A1TSHRPDE4DPTPN1
SCHEMBL24366316 0.83 PDE4B (0.55) PDE4BALDH1A1TSHRPDE4DPTPN1
SCHEMBL24588569 0.82 PDE4B (0.51) PDE4BALDH1A1TSHRPDE4DPTPN1
SCHEMBL31428576 0.81 FDPS (0.61) ALDH1A1TSHRFDPSHPGDTDP1

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
WO-2011009826-A2 NOVEL CHALCONE DERIVATIVES WITH CYTOTOXIC ACTIVITY ADAMED Sp.z o.o. (PL) 2011-01-27 WO 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 PDE4B 2619/4885ALDH1A1 450/4885TSHR 2912/4885

“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.