SCHEMBL1992451

SCHEMBL1992451

CN(c1ccnc(-c2cnc3ccc(C#N)cn23)n1)[C@@H]1CCCNC1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 2/20 0.51
EIF2AK4 Q9P2K8 7/20 0.44
FLT3 P36888 3/20 0.44
IRAK1 P51617 1/20 0.43
JAK2 O60674 7/20 0.42
JAK3 P52333 7/20 0.42
JAK1 P23458 3/20 0.42
NRAS P01111 1/20 0.38
MKNK1 Q9BUB5 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37

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
SCHEMBL1992453 1.00 IRAK4 (0.51) IRAK4EIF2AK4FLT3IRAK1JAK2
SCHEMBL1995794 0.87 FLT3 (0.44) IRAK4EIF2AK4FLT3IRAK1JAK2
SCHEMBL1995796 0.87 FLT3 (0.44) IRAK4EIF2AK4FLT3IRAK1JAK2
SCHEMBL2000440 0.83 IRAK4 (0.54) IRAK4FLT3NRAS
SCHEMBL2038127 0.79 EIF2AK4 (0.46) EIF2AK4JAK2JAK3JAK1
SCHEMBL12615148 0.79 EIF2AK4 (0.42) EIF2AK4JAK2JAK3JAK1MKNK1
SCHEMBL1994131 0.79 JAK2 (0.43) EIF2AK4FLT3JAK2JAK3JAK1
SCHEMBL1990855 0.78 IRAK4 (0.75) IRAK4EIF2AK4FLT3IRAK1JAK2
SCHEMBL1996010 0.78 IRAK4 (0.75) IRAK4EIF2AK4FLT3IRAK1JAK2
SCHEMBL1993336 0.78 IRAK4 (0.75) IRAK4EIF2AK4FLT3IRAK1JAK2

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 5 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 disclosed
US-20130216498-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2013-08-22 US disclosed
US-20130216498-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2013-08-22 US 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 IRAK4 12/4885EIF2AK4 211/4885FLT3 21/4885

“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.