SCHEMBL14919611

SCHEMBL14919611

CC(C)(C)OC(=O)N1CC(N)CCC1=O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
DDB1 Q16531 2/20 0.38
CRBN Q96SW2 2/20 0.38
KDM1A O60341 1/20 0.38
ELANE P08246 1/20 0.36
NR1H2 P55055 1/20 0.35
HPGD P15428 1/20 0.34
GPR119 Q8TDV5 2/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33

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
SCHEMBL16209734 1.00 KDM4E (0.41) KDM4EMAPTTHRBCHRM2CHRM1
SCHEMBL24364142 0.83 CHRM2 (0.41) KDM4EMAPTTHRBCHRM2CHRM1
SCHEMBL15570996 0.83 CHRM2 (0.41) KDM4EMAPTTHRBCHRM2CHRM1
SCHEMBL26663407 0.81 CHRM2 (0.41) KDM4EMAPTTHRBCHRM2CHRM1
SCHEMBL25037249 0.81 CHRM2 (0.41) KDM4EMAPTTHRBCHRM2CHRM1
SCHEMBL31251393 0.80 POLB (0.44) KDM4EMAPTTHRBCHRM2CHRM1
SCHEMBL16228718 0.80 POLB (0.44) KDM4EMAPTTHRBCHRM2CHRM1
SCHEMBL16228721 0.80 POLB (0.44) KDM4EMAPTTHRBCHRM2CHRM1
SCHEMBL29081264 0.79 CHRM2 (0.39) KDM4EMAPTTHRBCHRM2CHRM1
SCHEMBL24365642 0.79 NR1H2 (0.39) KDM4EMAPTTHRBCHRM2CHRM1

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
EP-2773207-B1 AMINOPYRIMIDINONES AS INTERLEUKIN RECEPTOR-ASSOCIATED KINASE INHIBITORS MERCK SHARP & DOHME (US) 2018-03-07 EP disclosed
US-9221809-B2 Aminopyrimidinones as interleukin receptor-associated kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2015-12-29 US disclosed
US-20140329799-A1 AMINOPYRIMIDINONES AS INTERLEUKIN RECEPTOR-ASSOCIATED KINASE INHIBITORS MERCK SHARP & DOHME LLC 2014-11-06 US disclosed
EP-2773207-A1 AMINOPYRIMIDINONES AS INTERLEUKIN RECEPTOR-ASSOCIATED KINASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2014-09-10 EP disclosed
WO-2013066729-A1 AMINOPYRIMIDINONES AS INTERLEUKIN RECEPTOR-ASSOCIATED KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2013-05-10 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 (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-20140329799-A1 AMINOPYRIMIDINONES AS INTERLEUKIN RECEPTOR-ASSOCIATED KINASE INHIBITORS IRAK4, IRAK1, IRAK2 KDM4E 260/4885MAPT 1924/4885THRB 2063/4885

“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.