SCHEMBL2385155

SCHEMBL2385155

Cc1cc(Nc2ncnc3nc(-c4c(Cl)cccc4Cl)[nH]c23)n[nH]1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 9/20 0.46
TYK2 P29597 9/20 0.46
GSK3B P49841 6/20 0.44
AURKA O14965 3/20 0.44
MEN1 O00255 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 1/20 0.44
PLK4 O00444 3/20 0.42
PAK4 O96013 3/20 0.42
AURKB Q96GD4 2/20 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
SCHEMBL2372732 0.84 TYK2 (0.64) JAK2TYK2GSK3B
SCHEMBL2372281 0.83 TYK2 (0.51) JAK2TYK2GSK3B
SCHEMBL12295623 0.83 TYK2 (0.51) JAK2TYK2GSK3B
SCHEMBL2372303 0.83 JAK2 (0.53) JAK2TYK2GSK3BHTTHSD17B10
SCHEMBL2372437 0.81 JAK2 (0.47) JAK2TYK2GSK3B
SCHEMBL2372667 0.81 JAK2 (0.44) JAK2TYK2GSK3BHTTHSD17B10
SCHEMBL2372127 0.81 TYK2 (0.63) JAK2TYK2GSK3B
SCHEMBL2372641 0.81 JAK2 (0.49) JAK2TYK2GSK3B
SCHEMBL2372344 0.81 GSK3B (0.45) JAK2TYK2GSK3B
SCHEMBL2371561 0.80 TYK2 (0.48) JAK2TYK2GSK3B

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 1/4885GSK3B 332/4885

“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.