SCHEMBL2562744

SCHEMBL2562744

COC(=O)c1coc(C2CC2)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAGLA Q9Y4D2 1/20 0.39
OPRK1 P41145 1/20 0.38
IRAK4 Q9NWZ3 3/20 0.38
FLT3 P36888 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
DYRK1A Q13627 4/20 0.35
GSK3B P49841 3/20 0.35
PRKCB P05771 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NTRK1 P04629 1/20 0.35
BACE1 P56817 1/20 0.35

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
SCHEMBL2079741 0.95 CHRM2 (0.37) DAGLAOPRK1IRAK4FLT3CHRM2
SCHEMBL3436251 0.95 CHRM2 (0.37) DAGLAOPRK1IRAK4FLT3CHRM2
SCHEMBL3436252 0.95 CHRM2 (0.37) DAGLAOPRK1IRAK4FLT3CHRM2
SCHEMBL21679113 0.91 DAGLA (0.37) DAGLAOPRK1IRAK4FLT3CHRM2
SCHEMBL13162790 0.91 IRAK4 (0.45) DAGLAOPRK1IRAK4FLT3CHRM2
SCHEMBL21679202 0.88 DAGLA (0.35) DAGLAOPRK1IRAK4FLT3CHRM2
SCHEMBL18781837 0.86 DYRK1A (0.37) DAGLAOPRK1IRAK4FLT3ALOX5AP
SCHEMBL3436217 0.85 CCNE1 (0.36) DAGLAOPRK1IRAK4FLT3CHRM2
SCHEMBL3436186 0.85 CCNE1 (0.36) DAGLAOPRK1IRAK4FLT3CHRM2
SCHEMBL2077925 0.85 CCNE1 (0.36) DAGLAOPRK1IRAK4FLT3CHRM2

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-2593102-B1 OXAZOLE DERIVATIVES USEFUL AS MODULATORS OF FAAH MERCK SHARP & DOHME (US) 2017-06-07 EP disclosed
US-9073879-B2 Oxazole derivatives useful as modulators of FAAH MERCK SHARP & DOHME CORP. (US) 2015-07-07 US disclosed
EP-2593102-A1 OXAZOLE DERIVATIVES USEFUL AS MODULATORS OF FAAH Merck Sharp & Dohme Corp. (US) 2013-05-22 EP disclosed
US-20130012526-A1 OXAZOLE DERIVATIVES USEFUL AS MODULATORS OF FAAH MERCK SHARP & DOHME CORP. (US) 2013-01-10 US disclosed
WO-2011133447-A1 OXAZOLE DERIVATIVES USEFUL AS MODULATORS OF FAAH MERCK SHARP & DOHME CORP. (US) 2011-10-27 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-20130012526-A1 OXAZOLE DERIVATIVES USEFUL AS MODULATORS OF FAAH FAAH, FAAH2, ALOX5 DAGLA 880/4885OPRK1 26/4885IRAK4 1790/4885

“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.