SCHEMBL2371684

SCHEMBL2371684

O=C(Nc1ncnc2nc(-c3c(Cl)cccc3Cl)[nH]c12)C1CC1

nearest known ligand 0.74

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 4/20 0.74
TYK2 P29597 12/20 0.60
JAK2 O60674 11/20 0.60
ABL1 P00519 2/20 0.43
HPGD P15428 1/20 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
SCHEMBL2372273 0.93 GSK3B (0.67) GSK3BTYK2JAK2ABL1
SCHEMBL2372411 0.85 GSK3B (0.53) GSK3BTYK2JAK2
SCHEMBL2372642 0.84 GSK3B (0.53) GSK3BTYK2JAK2
SCHEMBL2373081 0.83 GSK3B (0.52) GSK3BTYK2JAK2
SCHEMBL2371691 0.82 GSK3B (0.51) GSK3BTYK2JAK2
SCHEMBL12295615 0.82 TYK2 (0.69) GSK3BTYK2JAK2ABL1
SCHEMBL2385168 0.80 TYK2 (0.69) GSK3BTYK2JAK2ABL1HPGD
SCHEMBL2371959 0.78 JAK2 (0.46) GSK3BTYK2JAK2
SCHEMBL2371093 0.78 TYK2 (0.64) GSK3BTYK2JAK2ABL1
SCHEMBL2385013 0.77 TYK2 (0.66) GSK3BTYK2JAK2ABL1

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 GSK3B 332/4885TYK2 1/4885JAK2 6/4885

“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.