SCHEMBL21223

SCHEMBL21223

O=C1Cc2cc(Nc3nc4c(-c5ccc6cccnc6c5)nccn4n3)ccc2N1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.43
EIF2AK4 Q9P2K8 1/20 0.43
PTK2 Q05397 9/20 0.43
JAK2 O60674 2/20 0.43
JAK3 P52333 2/20 0.43
TBK1 Q9UHD2 1/20 0.41
PTK2B Q14289 6/20 0.41
BCL6 P41182 1/20 0.41
KDR P35968 3/20 0.41
PLK1 P53350 1/20 0.40
PDE10A Q9Y233 1/20 0.39
MET P08581 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
GRIA1 P42261 1/20 0.39

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
SCHEMBL21129 0.87 SYK (0.47) SYKEIF2AK4PTK2TBK1PTK2B
SCHEMBL21346 0.86 CYP1A2 (0.51) SYKEIF2AK4PTK2JAK2JAK3
SCHEMBL19658 0.85 SYK (0.46) SYKEIF2AK4PTK2JAK2JAK3
SCHEMBL19115 0.84 KDR (0.49) SYKEIF2AK4PTK2TBK1PTK2B
SCHEMBL20183 0.82 BCL6 (0.44) SYKEIF2AK4PTK2JAK3TBK1
SCHEMBL15207989 0.82 PLK1 (0.46) SYKEIF2AK4JAK3TBK1PTK2B
SCHEMBL21865 0.82 GRIA1 (0.44) SYKEIF2AK4PTK2TBK1PTK2B
SCHEMBL19454 0.82 SYK (0.44) SYKEIF2AK4PTK2JAK3TBK1
SCHEMBL20041 0.81 SYK (0.64) SYKEIF2AK4PTK2JAK2TBK1
SCHEMBL20534 0.81 SYK (0.45) SYKEIF2AK4PTK2JAK2JAK3

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-2609098-B1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2016-07-13 EP claimed
US-9023851-B2 Triazolopyrazine derivatives MERCK PATENT GMBH (DE) 2015-05-05 US claimed
US-20130225568-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 US claimed
EP-2609098-B1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2016-07-13 EP disclosed
EP-2609098-B1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2016-07-13 EP disclosed
US-9023851-B2 Triazolopyrazine derivatives MERCK PATENT GMBH (DE) 2015-05-05 US disclosed
US-9023851-B2 Triazolopyrazine derivatives MERCK PATENT GMBH (DE) 2015-05-05 US disclosed
US-20130225568-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 US disclosed
US-20130225568-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 US disclosed
EP-2609098-A1 TRIAZOLOPYRAZINE DERIVATIVES Merck Patent GmbH (DE) 2013-07-03 EP disclosed
WO-2012025186-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-03-01 WO disclosed
WO-2012025186-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-03-01 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-20130225568-A1 TRIAZOLOPYRAZINE DERIVATIVES SYK, IRAK1, ZAP70 SYK 1/4885EIF2AK4 1898/4885PTK2 367/4885

“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.