SCHEMBL1997512

SCHEMBL1997512

COc1ccnc(-c2cnc3ccccn23)n1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.52
KIT P10721 2/20 0.51
PIK3CA P42336 1/20 0.50
KDR P35968 3/20 0.46
FLT3 P36888 1/20 0.46
PKM P14618 2/20 0.45
IRAK4 Q9NWZ3 7/20 0.44
MAPK10 P53779 1/20 0.44
MIF P14174 1/20 0.43
FGFR3 P22607 1/20 0.42
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42
TP53 P04637 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CDK2 P24941 1/20 0.41

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
SCHEMBL1995363 0.87 PIK3CA (0.54) DYRK1AKITPIK3CAKDRFLT3
SCHEMBL21208173 0.82 DYRK1A (0.55) DYRK1AKITPIK3CAFLT3PKM
SCHEMBL21208267 0.80 DYRK1A (0.52) DYRK1AKITPIK3CAFLT3PKM
SCHEMBL16796241 0.80 FLT3 (0.57) DYRK1AKITPIK3CAKDRFLT3
SCHEMBL1995553 0.79 KIT (0.53) DYRK1AKITFLT3PKMIRAK4
SCHEMBL376358 0.79 KIT (0.53) DYRK1AKITFLT3PKMIRAK4
SCHEMBL29868755 0.79 PKM (0.54) DYRK1AKITFLT3PKMIRAK4
SCHEMBL21208172 0.78 KIT (0.61) DYRK1AKITKDRFLT3PKM
SCHEMBL1995340 0.78 JAK2 (0.43) DYRK1APIK3CA
SCHEMBL1997321 0.76 KIT (0.64) DYRK1AKITPKMIRAK4MAPK10

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 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
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
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
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 DYRK1A 1291/4885KIT 161/4885PIK3CA 136/4885

“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.