SCHEMBL2000394

SCHEMBL2000394

N#Cc1ccc2ncc(-c3nccc(NC4C5CC6CC4CC(O)(C6)C5)n3)n2c1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.44
IRAK4 Q9NWZ3 2/20 0.44
IRAK1 P51617 1/20 0.44
EIF2AK4 Q9P2K8 3/20 0.43
HSD11B1 P28845 9/20 0.40
JAK2 O60674 5/20 0.38
JAK3 P52333 5/20 0.38
JAK1 P23458 4/20 0.38

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
SCHEMBL12614713 1.00 FLT3 (0.44) FLT3IRAK4IRAK1EIF2AK4HSD11B1
SCHEMBL2038505 1.00 FLT3 (0.44) FLT3IRAK4IRAK1EIF2AK4HSD11B1
SCHEMBL2000396 1.00 FLT3 (0.44) FLT3IRAK4IRAK1EIF2AK4HSD11B1
SCHEMBL12614034 0.87 HSD11B1 (0.40) EIF2AK4HSD11B1JAK2JAK3JAK1
SCHEMBL1992847 0.78 EIF2AK4 (0.45) FLT3IRAK4IRAK1EIF2AK4JAK2
SCHEMBL1996184 0.77 IRAK4 (0.58) FLT3IRAK4IRAK1EIF2AK4JAK2
SCHEMBL1996185 0.77 IRAK4 (0.58) FLT3IRAK4IRAK1EIF2AK4JAK2
SCHEMBL1997583 0.77 IRAK4 (0.60) FLT3IRAK4IRAK1EIF2AK4JAK2
SCHEMBL2050343 0.75 EIF2AK4 (0.43) FLT3IRAK4IRAK1EIF2AK4JAK2
SCHEMBL1996579 0.75 IRAK4 (0.58) FLT3IRAK4IRAK1EIF2AK4JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130216498-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2013-08-22 US claimed
EP-2516436-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS Almirall S.A. (ES) 2012-10-31 EP claimed
WO-2011076419-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2011-06-30 WO claimed
EP-2338888-A1 Imidazopyridine derivatives as JAK inhibitors Almirall, S.A. (ES) 2011-06-29 EP claimed
US-20130216498-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2013-08-22 US disclosed
EP-2516436-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS Almirall S.A. (ES) 2012-10-31 EP disclosed
WO-2011076419-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2011-06-30 WO disclosed
EP-2338888-A1 Imidazopyridine derivatives as JAK inhibitors Almirall, S.A. (ES) 2011-06-29 EP 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-20130216498-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS JAK1, JAK2, JAK3 FLT3 21/4885IRAK4 12/4885IRAK1 15/4885

“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.