SCHEMBL20534

SCHEMBL20534

CS(=O)(=O)Nc1cccc(-c2nccn3nc(Nc4ccc5c(c4)CC(=O)N5)nc23)c1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.45
EIF2AK4 Q9P2K8 1/20 0.45
TDP2 O95551 2/20 0.44
PTK2 Q05397 9/20 0.41
PTK2B Q14289 4/20 0.41
JAK2 O60674 7/20 0.40
JAK3 P52333 7/20 0.40
ULK1 O75385 1/20 0.40
GRIA1 P42261 1/20 0.39
KIF11 P52732 1/20 0.39
KDR P35968 1/20 0.39
GLO1 Q04760 1/20 0.39
PIP4K2A P48426 1/20 0.39
PIP4K2B P78356 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 0.86 SYK (0.47) SYKEIF2AK4PTK2PTK2BGRIA1
SCHEMBL19115 0.86 KDR (0.49) SYKEIF2AK4PTK2PTK2BKIF11
SCHEMBL21346 0.84 CYP1A2 (0.51) SYKEIF2AK4PTK2PTK2BJAK2
SCHEMBL20183 0.84 BCL6 (0.44) SYKEIF2AK4PTK2PTK2BJAK3
SCHEMBL19454 0.83 SYK (0.44) SYKEIF2AK4TDP2PTK2PTK2B
SCHEMBL21865 0.81 GRIA1 (0.44) SYKEIF2AK4PTK2PTK2BGRIA1
SCHEMBL21223 0.81 SYK (0.43) SYKEIF2AK4PTK2PTK2BJAK2
SCHEMBL20041 0.81 SYK (0.64) SYKEIF2AK4PTK2PTK2BJAK2
SCHEMBL19658 0.80 SYK (0.46) SYKEIF2AK4TDP2PTK2PTK2B
SCHEMBL21074 0.79 PTK2 (0.42) SYKEIF2AK4PTK2PTK2BJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
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

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 1898/4885TDP2 284/4885

“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.