SCHEMBL19115

SCHEMBL19115

O=C1Cc2cc(Nc3nc4c(-c5cccc(O)c5)nccn4n3)ccc2N1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDR P35968 8/20 0.49
PLK1 P53350 5/20 0.47
SYK P43405 2/20 0.46
EIF2AK4 Q9P2K8 1/20 0.46
PTK2B Q14289 4/20 0.42
PTK2 Q05397 5/20 0.40
TBK1 Q9UHD2 1/20 0.40
BCL6 P41182 1/20 0.40
KIF11 P52732 1/20 0.40
NEK2 P51955 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
SCHEMBL21129 0.90 SYK (0.47) SYKEIF2AK4PTK2BPTK2TBK1
SCHEMBL19454 0.88 SYK (0.44) KDRPLK1SYKEIF2AK4PTK2B
SCHEMBL21346 0.88 CYP1A2 (0.51) KDRPLK1SYKEIF2AK4PTK2B
SCHEMBL20183 0.87 BCL6 (0.44) KDRSYKEIF2AK4PTK2BPTK2
SCHEMBL21865 0.87 GRIA1 (0.44) KDRPLK1SYKEIF2AK4PTK2B
SCHEMBL20534 0.86 SYK (0.45) KDRSYKEIF2AK4PTK2BPTK2
SCHEMBL21223 0.84 SYK (0.43) KDRPLK1SYKEIF2AK4PTK2B
SCHEMBL19658 0.83 SYK (0.46) KDRSYKEIF2AK4PTK2BPTK2
SCHEMBL15207989 0.83 PLK1 (0.46) PLK1SYKEIF2AK4PTK2BTBK1
SCHEMBL20041 0.82 SYK (0.64) KDRSYKEIF2AK4PTK2BPTK2

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 KDR 242/4885PLK1 692/4885SYK 1/4885

“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.