SCHEMBL10030830

SCHEMBL10030830

CC(C)(C)OC(=O)NCCc1nc2cc(Cl)c(Cl)cc2[nH]1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKAG1 P54619 1/20 0.54
PRKAA2 P54646 1/20 0.54
PRKAA1 Q13131 1/20 0.54
PRKAB1 Q9Y478 1/20 0.54
CACNA1G O43497 2/20 0.50
HTT P42858 4/20 0.48
GAA P10253 2/20 0.48
BCHE P06276 1/20 0.46
LMNA P02545 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
TP53 P04637 1/20 0.44
F9 P00740 2/20 0.44
CACNA1H O95180 2/20 0.43
STK17B O94768 1/20 0.43
STK17A Q9UEE5 1/20 0.43
CACNA1B Q00975 1/20 0.43
CACNA1C Q13936 1/20 0.43
EGLN1 Q9GZT9 1/20 0.43
HPGD P15428 2/20 0.42
MEN1 O00255 2/20 0.42

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
SCHEMBL23522706 0.88 CACNA1G (0.62) PRKAG1PRKAA2PRKAA1PRKAB1CACNA1G
SCHEMBL19378074 0.86 BCHE (0.49) HTTBCHELMNASMN1; SMN2TP53
SCHEMBL19408069 0.86 F9 (0.55) HTTBCHELMNASMN1; SMN2TP53
SCHEMBL16176294 0.81 PRKAG1 (0.68) PRKAG1PRKAA2PRKAA1PRKAB1CACNA1G
SCHEMBL6304380 0.81 BCHE (0.69) HTTGAABCHELMNASMN1; SMN2
SCHEMBL25926140 0.81 APEX1 (0.58) HTTBCHELMNASMN1; SMN2F9
SCHEMBL19408133 0.80 BCHE (0.46) HTTGAABCHELMNASMN1; SMN2
SCHEMBL13406081 0.75 TP53 (0.66) LMNASMN1; SMN2TP53F9HPGD
SCHEMBL16186541 0.75 CACNA1G (0.55) PRKAG1PRKAA2PRKAA1PRKAB1CACNA1G
SCHEMBL15173223 0.74 BRD4 (0.49) HTTGAABCHECACNA1HCACNA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120028975-A1 SUBSTITUTED TRIAZOLOPYRIDINES AND ANALOGS THEREOF SCHERING CORPORATION 2012-02-02 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-20120028975-A1 SUBSTITUTED TRIAZOLOPYRIDINES AND ANALOGS THEREOF PDE2A, PDE5A, PDE4A PRKAG1 155/4885PRKAA2 153/4885PRKAA1 154/4885

“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.