SCHEMBL1492350

SCHEMBL1492350

CCOC(=O)c1c(NC(C)=O)cc(Cl)n1-c1ccc(CC)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.43
HPGD P15428 4/20 0.43
KMT2A Q03164 2/20 0.43
HTT P42858 2/20 0.43
MAPK1 P28482 2/20 0.43
ALDH1A1 P00352 6/20 0.42
GAA P10253 2/20 0.42
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.40
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
LMNA P02545 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
GALR2 O43603 1/20 0.39
MITF O75030 1/20 0.39
POLB P06746 1/20 0.39
HSP90AA1 P07900 1/20 0.39
XBP1 P17861 1/20 0.39
CCR6 P51684 1/20 0.39
KDM4E B2RXH2 2/20 0.38

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
SCHEMBL1492311 0.89 KMT2A (0.42) SMN1; SMN2HPGDKMT2AHTTMAPK1
SCHEMBL1492272 0.88 ALDH1A1 (0.52) SMN1; SMN2HPGDKMT2AHTTMAPK1
SCHEMBL1492252 0.85 MAPK8 (0.50) SMN1; SMN2HPGDKMT2AMAPK1ALDH1A1
SCHEMBL10008340 0.83 CASP3 (0.40) SMN1; SMN2HPGDKMT2AHTTMAPK1
SCHEMBL1492266 0.83 SMN1; SMN2 (0.41) SMN1; SMN2HPGDKMT2AHTTMAPK1
SCHEMBL1492407 0.81 HPGD (0.48) SMN1; SMN2HPGDHTTMAPK1ALDH1A1
SCHEMBL2592876 0.79 MAPT (0.43) SMN1; SMN2HPGDKMT2AHTTMAPK1
SCHEMBL10008582 0.79 SMN1; SMN2 (0.48) SMN1; SMN2HPGDKMT2AHTTMAPK1
SCHEMBL10008612 0.78 MAPK8 (0.50) HPGDKMT2AHTTALDH1A1GAA
SCHEMBL1492397 0.77 ALDH1A1 (0.41) HPGDKMT2AHTTMAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2475660-A1 PYRROLO-PYRIDINE DERIVATIVES AS ACTIVATORS OF AMPK GlaxoSmithKline LLC (US) 2012-07-18 EP disclosed
US-20120172333-A1 PYRROLO-PYRIDINE DERIVATIVES AS ACTIVATORS OF AMPK GLAXOSMITHKLINE LLC (US) 2012-07-05 US disclosed
WO-2011029855-A1 PYRROLO-PYRIDINE DERIVATIVES AS ACTIVATORS OF AMPK GLAXOSMITHKLINE LLC (US) 2011-03-17 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-20120172333-A1 PYRROLO-PYRIDINE DERIVATIVES AS ACTIVATORS OF AMPK PRKAB1, PRKAG1, PRKAB2 SMN1; SMN2 4359/4885HPGD 499/4885KMT2A 2761/4885

“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.