SCHEMBL2382873

SCHEMBL2382873

Nc1ncnc(Nc2ncnc3nc(-c4c(Cl)cccc4Cl)[nH]c23)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
GSK3B P49841 3/20 0.45
ADORA3 P0DMS8 1/20 0.42
SLC6A2 P23975 1/20 0.42
PDE4A P27815 1/20 0.42
KDR P35968 1/20 0.42
JAK2 O60674 3/20 0.42
TYK2 P29597 3/20 0.42
BCL6 P41182 1/20 0.41
MAPK1 P28482 1/20 0.40
CSF1R P07333 1/20 0.38
PI4KA P42356 2/20 0.38
PI4K2B Q8TCG2 2/20 0.38
PI4K2A Q9BTU6 2/20 0.38
PI4KB Q9UBF8 2/20 0.38
HTT P42858 1/20 0.38
KCNH2 Q12809 1/20 0.38
SCN5A Q14524 1/20 0.38
SCN9A Q15858 1/20 0.38
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL2372127 0.81 TYK2 (0.63) GSK3BJAK2TYK2
SCHEMBL2372641 0.81 JAK2 (0.49) GSK3BJAK2TYK2CSF1RPI4KA
SCHEMBL12295222 0.80 JAK2 (0.47) GSK3BJAK2TYK2CSF1RPI4KA
SCHEMBL2371959 0.79 JAK2 (0.46) GSK3BJAK2TYK2CSF1RPI4KA
SCHEMBL2371592 0.79 JAK2 (0.52) GSK3BKDRJAK2TYK2HTT
SCHEMBL2371998 0.79 GSK3B (0.43) LMNAGSK3BJAK2TYK2CSF1R
SCHEMBL2372281 0.79 TYK2 (0.51) GSK3BJAK2TYK2CSF1R
SCHEMBL2372185 0.77 PI4KA (0.61) LMNAJAK2TYK2PI4KAPI4K2B
SCHEMBL2372344 0.77 GSK3B (0.45) GSK3BJAK2TYK2CSF1R
SCHEMBL2372732 0.76 TYK2 (0.64) GSK3BJAK2TYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130096104-A1 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE GENENTECH, INC. (US) 2013-04-18 US disclosed
US-20130096104-A1 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE GENENTECH, INC. (US) 2013-04-18 US disclosed
US-20130096104-A1 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE GENENTECH, INC. (US) 2013-04-18 US disclosed
EP-2547338-A2 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. Hoffmann-La Roche AG (CH) 2013-01-23 EP disclosed
WO-2011113802-A2 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2011-09-22 WO disclosed
WO-2011113802-A2 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2011-09-22 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-20130096104-A1 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE TYK2, IRAK1, IRAK4 LMNA 2401/4885GSK3B 332/4885ADORA3 1008/4885

“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.