SCHEMBL10044101

SCHEMBL10044101

CCC(C)C(=O)C(=O)NCCc1ccc(O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.57
F13A1 P00488 1/20 0.57
GAA P10253 3/20 0.51
ABCG2 Q9UNQ0 1/20 0.51
ESRRG P62508 6/20 0.50
PLAAT3 P53816 1/20 0.49
PLAAT5 Q96KN8 1/20 0.49
PLAAT2 Q9NWW9 1/20 0.49
PLAAT4 Q9UL19 1/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2D6 P10635 2/20 0.49
CYP2C19 P33261 2/20 0.49
NPC1 O15118 1/20 0.49
MAPT P10636 1/20 0.49
RAB9A P51151 1/20 0.49
GFER P55789 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ESRRB O95718 3/20 0.47
TMEM97 Q5BJF2 1/20 0.46
SIGMAR1 Q99720 1/20 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
SCHEMBL18324609 0.84 GAA (0.68) KDM4EF13A1GAAABCG2ESRRG
SCHEMBL15358690 0.77 KDM4E (0.73) KDM4EF13A1GAAABCG2ESRRG
SCHEMBL2723945 0.77 KDM4E (0.58) KDM4EF13A1GAAABCG2ESRRG
SCHEMBL12164125 0.76 KDM4E (0.66) KDM4EF13A1GAAABCG2ESRRG
SCHEMBL105520 0.76 KDM4E (0.71) KDM4EF13A1GAAABCG2ESRRG
SCHEMBL10044110 0.75 KDM4E (0.55) KDM4EF13A1GAAESRRGCYP2D6
SCHEMBL4949918 0.74 KDM4E (0.64) KDM4EF13A1GAAABCG2ESRRG
SCHEMBL29655176 0.74 KDM4E (0.64) KDM4EF13A1GAAABCG2ESRRG
SCHEMBL5060920 0.74 KDM4E (0.64) KDM4EF13A1GAAABCG2ESRRG
SCHEMBL8622037 0.74 ESR1 (0.59) KDM4EF13A1ABCG2ESRRGPLAAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015081390-A2 METHOD FOR CONTROLLING ANT COLONIES KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2015-06-11 WO claimed
US-11767289-B2 Methods and compositions for pest control UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2023-09-26 US disclosed
US-11767289-B2 Methods and compositions for pest control UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2023-09-26 US disclosed
US-20220234997-A1 Methods and Compositions for Pest Control THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE 2022-07-28 US disclosed
US-9950994-B2 Methods and compositions for pest control VMI FOUNDATION (US) 2018-04-24 US disclosed
US-9950994-B2 Methods and compositions for pest control VMI FOUNDATION (US) 2018-04-24 US disclosed
US-20180009740-A1 Methods and Compositions for Pest Control THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE 2018-01-11 US disclosed
WO-2015081390-A2 METHOD FOR CONTROLLING ANT COLONIES KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2015-06-11 WO disclosed
US-20130289125-A1 Methods and Compositions for Pest Control THE VMI FOUNDATION 2013-10-31 US disclosed
US-20130289125-A1 Methods and Compositions for Pest Control THE VMI FOUNDATION 2013-10-31 US disclosed
WO-2012061624-A2 Methods and Compositions for Pest Control VMI FOUNDATION (US) 2012-05-10 WO 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 (4 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-11767289-B2 Methods and compositions for pest control TYR, GLMN, SGMS2 KDM4E 424/4885F13A1 3867/4885GAA 1430/4885
US-20130289125-A1 Methods and Compositions for Pest Control TYR, GLMN, SGMS2 KDM4E 424/4885F13A1 3867/4885GAA 1430/4885
US-20180009740-A1 Methods and Compositions for Pest Control TYR, GLMN, SGMS2 KDM4E 424/4885F13A1 3867/4885GAA 1430/4885
US-20220234997-A1 Methods and Compositions for Pest Control TYR, GLMN, SGMS2 KDM4E 424/4885F13A1 3867/4885GAA 1430/4885

“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.