SCHEMBL2643493

SCHEMBL2643493

COc1ccc(CN2C(=O)C(C)=CC2O)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
HKDC1 Q2TB90 1/20 0.50
CMA1 P23946 1/20 0.49
GSK3A P49840 2/20 0.46
GSK3B P49841 2/20 0.46
ALDH1A1 P00352 2/20 0.45
MAPT P10636 2/20 0.45
ALOX15 P16050 1/20 0.45
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
CASP3 P42574 1/20 0.43
HTT P42858 1/20 0.41
HCRTR1 O43613 1/20 0.41
HCRTR2 O43614 1/20 0.41

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
SCHEMBL18317056 0.87 GSK3A (0.50) GSK3AGSK3BALDH1A1MAPTMEN1
SCHEMBL17047716 0.81 MEN1 (0.46) KDM4ECMA1ALDH1A1ALOX15MEN1
SCHEMBL2644855 0.78 KDM4E (0.57) KDM4EHKDC1CMA1GSK3AGSK3B
SCHEMBL2644221 0.77 KDM4E (0.50) KDM4EHKDC1CMA1GSK3AGSK3B
SCHEMBL31148998 0.75 GSK3A (0.55) KDM4EHKDC1CMA1GSK3AGSK3B
SCHEMBL18317059 0.74 RAB9A (0.51) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL17962619 0.73 KDM4E (0.56) KDM4EHKDC1CMA1GSK3AGSK3B
SCHEMBL21847080 0.72 KDM4E (0.51) KDM4EHKDC1CMA1GSK3AGSK3B
SCHEMBL18476756 0.71 CMA1 (0.50) KDM4EHKDC1CMA1GSK3AGSK3B
SCHEMBL20719766 0.71 HCRTR2 (0.55) KDM4EHKDC1CMA1GSK3AGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160368900-A1 PLANT GROWTH REGULATING COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-12-22 US claimed
WO-2022150707-A1 FUSED QUADRACYCLIC COMPOUNDS, COMPOSITIONS AND USES THEREOF Tabomedex Biosciences, Inc. (US) 2022-07-14 WO disclosed
EP-3110808-B1 PLANT GROWTH REGULATING COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-08-29 EP disclosed
US-9751867-B2 Plant growth regulating compounds SYNGENTA PARTICIPATIONS AG (CH) 2017-09-05 US disclosed
US-20160368900-A1 PLANT GROWTH REGULATING COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-12-22 US disclosed
US-8680122-B2 Substituted pyrrolones as allosteric modulators of glucokinase JANSSEN PHARMACETICA N.V. (BE) 2014-03-25 US disclosed
EP-1951707-A1 SUBSTITUTED PYRROLONES AS ALLOSTERIC MODULATORS OF GLUCOKINASE JANSSEN PHARMACEUTICA N.V. (BE) 2008-08-06 EP disclosed
WO-2007053657-A1 SUBSTITUTED PYRROLONES AS ALLOSTERIC MODULATORS OF GLUCOKINASE JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-10 WO disclosed
US-20070099937-A1 Substituted Pyrrolones As Allosteric Modulators of Glucokinase JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-03 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 (2 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-20160368900-A1 PLANT GROWTH REGULATING COMPOUNDS GHDC, GAK, EIF4G2 KDM4E 2890/4885HKDC1 1732/4885CMA1 3317/4885
US-20070099937-A1 Substituted Pyrrolones As Allosteric Modulators of Glucokinase GCK, GCKR, PDXK KDM4E 1136/4885HKDC1 149/4885CMA1 4071/4885

“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.