SCHEMBL19806

SCHEMBL19806

COCC(O)Cn1cc(-c2nccn3nc(Nc4ccc5c(c4)CC(=O)N5)nc23)cn1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.51
EIF2AK4 Q9P2K8 1/20 0.51
JAK2 O60674 5/20 0.39
TYK2 P29597 4/20 0.39
ROCK1 Q13464 1/20 0.38
PTK2 Q05397 6/20 0.37
JAK1 P23458 2/20 0.37
JAK3 P52333 2/20 0.37
TTK P33981 1/20 0.37
PTK2B Q14289 4/20 0.36
BCL6 P41182 1/20 0.35
KDR P35968 2/20 0.35
INSR P06213 1/20 0.34
PLK1 P53350 1/20 0.34
AURKB Q96GD4 1/20 0.34
GRIA1 P42261 1/20 0.34
TBK1 Q9UHD2 1/20 0.34

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
SCHEMBL19831 0.90 SYK (0.51) SYKEIF2AK4JAK2TYK2PTK2
SCHEMBL20041 0.83 SYK (0.64) SYKEIF2AK4JAK2TYK2PTK2
SCHEMBL22189 0.79 JAK2 (0.49) SYKEIF2AK4JAK2TYK2PTK2
SCHEMBL21129 0.77 SYK (0.47) SYKEIF2AK4PTK2PTK2BBCL6
SCHEMBL15221133 0.77 SYK (0.69) SYKEIF2AK4JAK2TYK2TTK
SCHEMBL21346 0.77 CYP1A2 (0.51) SYKEIF2AK4JAK2PTK2JAK3
SCHEMBL19115 0.76 KDR (0.49) SYKEIF2AK4PTK2PTK2BBCL6
SCHEMBL15207989 0.75 PLK1 (0.46) SYKEIF2AK4JAK3PTK2BPLK1
SCHEMBL19658 0.75 SYK (0.46) SYKEIF2AK4JAK2PTK2JAK3
SCHEMBL20183 0.73 BCL6 (0.44) SYKEIF2AK4PTK2JAK3PTK2B

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 13 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-A1 TRIAZOLOPYRAZINE DERIVATIVES Merck Patent GmbH (DE) 2013-07-03 EP claimed
WO-2012025186-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-03-01 WO claimed
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 1898/4885JAK2 5/4885

“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.