SCHEMBL2145178

SCHEMBL2145178

CNC(=O)c1ccc(Nc2nc3cccc(N[C@H]4CC[C@H](N)CC4)n3n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIT P10721 4/20 0.53
FLT3 P36888 4/20 0.53
SYK P43405 2/20 0.48
JAK2 O60674 4/20 0.45
MAPKAPK2 P49137 2/20 0.43
SCN9A Q15858 1/20 0.42
JAK1 P23458 2/20 0.41
MAP3K5 Q99683 1/20 0.41
JAK3 P52333 2/20 0.40
AURKA O14965 1/20 0.40
EGFR P00533 1/20 0.40
NTRK1 P04629 1/20 0.40
CDK1 P06493 1/20 0.40
IGF1R P08069 1/20 0.40
EPHA1 P21709 1/20 0.40
CDK2 P24941 1/20 0.40
BMX P51813 1/20 0.40
CDK6 Q00534 1/20 0.40
PAK1 Q13153 1/20 0.40
ALK Q9UM73 1/20 0.40

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
SCHEMBL2144499 1.00 KIT (0.53) KITFLT3SYKJAK2MAPKAPK2
SCHEMBL2144507 1.00 KIT (0.53) KITFLT3SYKJAK2MAPKAPK2
SCHEMBL2144293 0.91 SYK (0.47) KITFLT3SYKJAK2SCN9A
SCHEMBL2144287 0.91 SYK (0.47) KITFLT3SYKJAK2SCN9A
SCHEMBL2144871 0.91 SYK (0.47) KITFLT3SYKJAK2SCN9A
SCHEMBL2144281 0.91 SYK (0.49) KITFLT3SYKJAK2MAPKAPK2
SCHEMBL2143939 0.89 FLT3 (0.51) KITFLT3SYKJAK2MAPKAPK2
SCHEMBL2144641 0.89 FLT3 (0.51) KITFLT3SYKJAK2MAPKAPK2
SCHEMBL2143946 0.89 FLT3 (0.51) KITFLT3SYKJAK2MAPKAPK2
SCHEMBL2143969 0.89 SYK (0.44) KITFLT3SYKJAK2SCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2344494-B1 AMINOTRIAZOLOPYRIDINES AND THEIR USE AS KINASE INHIBITORS SIGNAL PHARM LLC (US) 2016-04-20 EP claimed
US-20130005707-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BAHMANYAR SOGOLE (US) 2013-01-03 US claimed
US-8299056-B2 Aminotriazolopyridines, compositions thereof, and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC (US) 2012-10-30 US claimed
EP-2344494-A1 AMINOTRIAZOLOPYRIDINES AND THEIR USE AS KINASE INHIBITORS Signal Pharmaceuticals, LLC (US) 2011-07-20 EP claimed
US-20100093698-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH SIGNAL PHARMACEUTICALS, LLC 2010-04-15 US claimed
WO-2010027500-A1 AMINOTRIAZOLOPYRIDINES AND THEIR USE AS KINASE INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2010-03-11 WO claimed
EP-2344494-B1 AMINOTRIAZOLOPYRIDINES AND THEIR USE AS KINASE INHIBITORS SIGNAL PHARM LLC (US) 2016-04-20 EP disclosed
US-20130005707-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BAHMANYAR SOGOLE (US) 2013-01-03 US disclosed
US-8299056-B2 Aminotriazolopyridines, compositions thereof, and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC (US) 2012-10-30 US disclosed
EP-2344494-A1 AMINOTRIAZOLOPYRIDINES AND THEIR USE AS KINASE INHIBITORS Signal Pharmaceuticals, LLC (US) 2011-07-20 EP disclosed
US-20100093698-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH SIGNAL PHARMACEUTICALS, LLC 2010-04-15 US disclosed
WO-2010027500-A1 AMINOTRIAZOLOPYRIDINES AND THEIR USE AS KINASE INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2010-03-11 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 (2 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-20130005707-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH MAP3K2, MAP3K1, MAP3K3 KIT 582/4885FLT3 185/4885SYK 387/4885
US-20100093698-A1 AMINOTRIAZOLOPYRIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH MAP3K2, MAP3K1, MAP3K3 KIT 582/4885FLT3 185/4885SYK 387/4885

“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.