SCHEMBL2371529

SCHEMBL2371529

COc1cc(Nc2ncnc3nc(-c4c(Cl)cc(C#N)cc4Cl)[nH]c23)ncn1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 11/20 0.50
TYK2 P29597 11/20 0.50
JAK1 P23458 1/20 0.50
CDK2 P24941 1/20 0.50
CDK9 P50750 1/20 0.50
JAK3 P52333 1/20 0.50
GSK3B P49841 4/20 0.43
SLC34A1 Q06495 1/20 0.32
EGFR P00533 1/20 0.31
ERBB2 P04626 1/20 0.31
ERBB3 P21860 1/20 0.31
ERBB4 Q15303 1/20 0.31
CHRNA7 P36544 1/20 0.31
TNF P01375 1/20 0.30
IRAK4 Q9NWZ3 1/20 0.30

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
SCHEMBL2371913 0.87 TYK2 (0.65) JAK2TYK2JAK1CDK2CDK9
SCHEMBL2372232 0.86 TYK2 (0.64) JAK2TYK2JAK1CDK2CDK9
SCHEMBL12296262 0.86 TYK2 (0.59) JAK2TYK2JAK1CDK2CDK9
SCHEMBL2372268 0.84 TYK2 (0.50) JAK2TYK2JAK1CDK2CDK9
SCHEMBL2371916 0.84 JAK2 (0.57) JAK2TYK2JAK1CDK2CDK9
SCHEMBL2372447 0.84 JAK2 (0.56) JAK2TYK2JAK1CDK2CDK9
SCHEMBL2371896 0.83 JAK2 (0.49) JAK2TYK2JAK1CDK2CDK9
SCHEMBL2372423 0.82 JAK2 (0.48) JAK2TYK2JAK1CDK2CDK9
SCHEMBL2372520 0.82 JAK2 (0.52) JAK2TYK2JAK1CDK2CDK9
SCHEMBL2371817 0.82 TYK2 (0.48) JAK2TYK2JAK1CDK2CDK9

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 JAK2 6/4885TYK2 1/4885JAK1 7/4885

“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.