SCHEMBL2372016

SCHEMBL2372016

Cc1cc(Nc2nccc3nc(-c4c(Cl)cccc4Cl)[nH]c23)nc(N(CCO)CCO)n1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 18/20 0.57
JAK2 O60674 14/20 0.57
DGAT1 O75907 1/20 0.36
JAK1 P23458 1/20 0.36
CDK2 P24941 1/20 0.36
CDK9 P50750 1/20 0.36
JAK3 P52333 1/20 0.36
KDR P35968 1/20 0.35

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
SCHEMBL2372952 0.92 TYK2 (0.58) TYK2JAK2DGAT1JAK1CDK2
SCHEMBL12296273 0.88 TYK2 (0.72) TYK2JAK2DGAT1JAK1CDK2
SCHEMBL12294563 0.83 TYK2 (0.55) TYK2JAK2JAK1CDK2CDK9
SCHEMBL2371723 0.83 TYK2 (0.55) TYK2JAK2DGAT1JAK1CDK2
SCHEMBL2372687 0.81 TYK2 (0.55) TYK2JAK2JAK1CDK2CDK9
SCHEMBL2372864 0.80 TYK2 (0.47) TYK2JAK2
SCHEMBL2372339 0.80 TYK2 (0.70) TYK2JAK2JAK1CDK2CDK9
SCHEMBL2372563 0.79 JAK2 (0.55) TYK2JAK2KDR
SCHEMBL2372652 0.79 TYK2 (0.51) TYK2JAK2DGAT1JAK1CDK2
SCHEMBL12295203 0.78 TYK2 (0.56) TYK2JAK2KDR

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 TYK2 1/4885JAK2 6/4885DGAT1 4862/4885

“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.