SCHEMBL19736062

SCHEMBL19736062

COc1ccc(O)cc1C1CC(=O)c2c(O)c(OC)c(OC)c(OC)c2O1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS2R31 P59538 1/20 0.54
MAPT P10636 2/20 0.47
POLB P06746 2/20 0.47
MEN1 O00255 1/20 0.47
GAA P10253 1/20 0.47
PABPC1 P11940 1/20 0.47
APEX1 P27695 1/20 0.47
RECQL P46063 1/20 0.47
KMT2A Q03164 1/20 0.47
EIF4H Q15056 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
GUSB P08236 4/20 0.46
IDO1 P14902 1/20 0.46
CYP19A1 P11511 4/20 0.46
TP53 P04637 2/20 0.46
CYP3A4 P08684 2/20 0.46
XDH P47989 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
PTGS2 P35354 2/20 0.46

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
SCHEMBL19736061 0.93 TAS2R31 (0.54) TAS2R31MAPTPOLBMEN1GAA
SCHEMBL19033824 0.91 TAS2R31 (0.51) TAS2R31MAPTPOLBMEN1GAA
SCHEMBL27775946 0.90 IDO1 (0.49) TAS2R31MAPTPOLBGUSBIDO1
SCHEMBL4129038 0.83 TAS2R31 (0.57) TAS2R31MAPTPOLBMEN1GAA
SCHEMBL19736056 0.82 IDO1 (0.51) TAS2R31MAPTIDO1CYP19A1NPC1
SCHEMBL782044 0.76 TAS2R31 (0.74) TAS2R31MAPTPOLBCYP19A1TP53
SCHEMBL4225984 0.76 TAS2R31 (0.74) TAS2R31MAPTPOLBCYP19A1TP53
SCHEMBL16894655 0.76 CYP1A1 (0.60) TAS2R31MAPTPOLBMEN1GAA
SCHEMBL14421486 0.76 TAS2R31 (0.57) TAS2R31MAPTPOLBMEN1GAA
SCHEMBL19736058 0.74 ODC1 (0.49) TAS2R31MAPTPOLBMEN1GAA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170360744-A1 AGENT CONTAINING FLAVONOID DERIVATIVES FOR TREATING CANCER AND INFLAMMATION FLAVOCURE BIOTECH INC. 2017-12-21 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-20170360744-A1 AGENT CONTAINING FLAVONOID DERIVATIVES FOR TREATING CANCER AND INFLAMMATION TNF, NLRP3, F3 TAS2R31 2271/4885MAPT 1505/4885POLB 2632/4885

“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.