SCHEMBL13263642

SCHEMBL13263642

COc1cccc(COc2ccccc2)c1

nearest known ligand 0.79

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 9/20 0.79
▸ IDO1 P14902 2/20 0.65
▸ AGXT P21549 2/20 0.65
▸ BCHE P06276 2/20 0.62
▸ ABCB1 P08183 2/20 0.62
▸ HTR1A P08908 2/20 0.62
▸ DRD2 P14416 2/20 0.62
▸ MRGPRX4 Q96LA9 2/20 0.62
▸ TP53 P04637 1/20 0.59
▸ PKM P14618 1/20 0.59
▸ NFKB1 P19838 1/20 0.59
▸ RAB9A P51151 1/20 0.59
▸ NFKB2 Q00653 1/20 0.59
▸ RELA Q04206 1/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ RXFP1 Q9HBX9 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
SCHEMBL22873 0.93 MAOB (0.70) MAOBIDO1AGXTBCHEABCB1
SCHEMBL14547318 0.92 MAOB (0.81) MAOBIDO1AGXTBCHEABCB1
SCHEMBL791569 0.89 MAOB (1.00) MAOBBCHEABCB1HTR1ADRD2
SCHEMBL171916 0.87 MAOB (0.73) MAOBIDO1AGXTBCHEMRGPRX4
SCHEMBL15730033 0.87 MAOB (0.62) MAOBIDO1AGXTBCHEABCB1
SCHEMBL16710547 0.87 MAOB (0.71) MAOBIDO1AGXTBCHEABCB1
SCHEMBL13332739 0.86 MAOB (0.70) MAOBBCHEABCB1MRGPRX4
SCHEMBL920589 0.86 MAOB (0.67) MAOBIDO1AGXTBCHEABCB1
SCHEMBL21260547 0.86 MAOB (0.73) MAOBIDO1AGXTBCHEABCB1
SCHEMBL1680537 0.86 MAOB (1.00) MAOBIDO1AGXTBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11198754-B2 Heat-curing epoxy resin composition containing non-aromatic ureas as accelerator SIKA TECHNOLOGY AG (CH) 2021-12-14 — — US disclosed
US-20190002626-A1 HEAT-CURING EPOXY RESIN COMPOSITION CONTAINING NON-AROMATIC UREAS AS ACCELERATOR SIKA TECHNOLOGY AG (CH) 2019-01-03 — — US disclosed
US-9196860-B2 Compounds for triplet-triplet annihilation upconversion UNIVERSAL DISPLAY CORPORATION (US) 2015-11-24 — — US disclosed
US-20140151646-A1 COMPOUNDS FOR TRIPLET-TRIPLET ANNIHILATION UPCONVERSION UNIVERSAL DISPLAY CORPORATION 2014-06-05 — — US disclosed
US-20100166655-A1 1, 4-DISUBSTITUTED 3-CYANO-PYRIDONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS JANSSEN PHARMACEUTICA N.V. (BE) 2010-07-01 — — 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-20100166655-A1 1, 4-DISUBSTITUTED 3-CYANO-PYRIDONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS GRM2, GRM1, GRM3 MAOB 1392/4885IDO1 1055/4885AGXT 3886/4885

“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.

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