SCHEMBL20154

SCHEMBL20154

O=C1Cc2cc(N=C=S)ccc2N1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AHR P35869 4/20 0.51
PDE3B Q13370 1/20 0.46
PDE3A Q14432 1/20 0.46
PNMT P11086 1/20 0.45
PDK2 Q15119 1/20 0.44
EPHX2 P34913 1/20 0.44
PGR P06401 4/20 0.43
GRIA1 P42261 2/20 0.43
CACNG8 Q8WXS5 2/20 0.43
EIF2AK2 P19525 1/20 0.42
MAOB P27338 3/20 0.42
CYP1A2 P05177 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
GAA P10253 1/20 0.40
CMA1 P23946 2/20 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
SCHEMBL15218966 0.81 AHR (0.56) AHRPDE3BPDE3APDK2EPHX2
SCHEMBL7650115 0.80 AHR (0.58) AHRPDE3BPDE3APDK2EPHX2
SCHEMBL7273904 0.76 CA9 (0.53) PNMTMAOB
SCHEMBL14006308 0.70 PNMT (0.44) PNMT
SCHEMBL5535534 0.68 AHR (0.61) AHRPDE3BPDE3APDK2EPHX2
SCHEMBL2468488 0.68 AHR (0.61) AHRPDE3BPDE3APDK2EPHX2
SCHEMBL1459491 0.68 TDP2 (0.62) AHRPDE3BPDE3APDK2EPHX2
SCHEMBL6431 0.68 AHR (0.72) AHRPDE3BPDE3APDK2EPHX2
SCHEMBL19391 0.68 AHR (0.67) AHRPDE3BPDE3APDK2EPHX2
SCHEMBL433708 0.68 AHR (0.61) AHRPDE3BPDE3APDK2EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2817310-B1 8-SUBSTITUTED 2-AMINO-[1,2,4]TRIAZOLO[1,5-A]PYRAZINES AS SYK TRYROSINE KINASE INHIBITORS AND GCN2 SERIN KINASE INHIBITORS MERCK PATENT GMBH (DE) 2018-03-21 EP disclosed
CN-104114557-B 8-substituted 2-amino- [1,2,4] triazolo [1,5-a ] pyrazines as SYK tyrosine kinase inhibitors and GCN2 serine kinase inhibitors 默克专利股份公司 2017-10-24 CN disclosed
EP-2609098-B1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2016-07-13 EP disclosed
CN-103068828-B Triazolopyrazine Derivatives MERCK PATENT GMBH (DE) 2015-09-09 CN disclosed
US-9120804-B2 8-substituted 2-amino-[1,2,4] triazolo [1, 5-A] pyrazines as Syk tryrosine kinase inhibitors and GCN2 serin kinase inhibitors MERCK PATENT GMBH (DE) 2015-09-01 US disclosed
US-9023851-B2 Triazolopyrazine derivatives MERCK PATENT GMBH (DE) 2015-05-05 US disclosed
US-20150025058-A1 8 - SUBSTITUTED 2 -AMINO - [1,2,4] TRIAZOLO [1, 5 -A] PYRAZINES AS SYK TRYROSINE KINASE INHIBITORS AND GCN2 SERIN KINASE INHIBITORS MERCK PATENT GMBH (DE) 2015-01-22 US disclosed
EP-2817310-A1 8 - SUBSTITUTED 2 -AMINO - [1,2,4]TRIAZOLO [1, 5 -A]PYRAZINES AS SYK TRYROSINE KINASE INHIBITORS AND GCN2 SERIN KINASE INHIBITORS Merck Patent GmbH (DE) 2014-12-31 EP disclosed
CN-104114557-A 8-substituted 2-amino- [1,2,4] triazolo [1,5-a ] pyrazines as SYK tyrosine kinase inhibitors and GCN2 serine kinase inhibitors MERCK PATENT GMBH 2014-10-22 CN disclosed
US-20130225568-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 US disclosed
WO-2013124026-A1 8 - SUBSTITUTED 2 -AMINO - [1,2,4] TRIAZOLO [1, 5 -A] PYRAZINES AS SYK TRYROSINE KINASE INHIBITORS AND GCN2 SERIN KINASE INHIBITORS MERCK PATENT GMBH (DE) 2013-08-29 WO disclosed
EP-2609098-A1 TRIAZOLOPYRAZINE DERIVATIVES Merck Patent GmbH (DE) 2013-07-03 EP disclosed
CN-103068828-A Triazolopyrazine derivatives MERCK PATENT GMBH 2013-04-24 CN 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 (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-20150025058-A1 8 - SUBSTITUTED 2 -AMINO - [1,2,4] TRIAZOLO [1, 5 -A] PYRAZINES AS SYK TRYROSINE KINASE INHIBITORS AND GCN2 SERIN KINASE INHIBITORS SYK, EIF2AK4, BTK AHR 3362/4885PDE3B 2705/4885PDE3A 2474/4885
US-20130225568-A1 TRIAZOLOPYRAZINE DERIVATIVES SYK, IRAK1, ZAP70 AHR 1961/4885PDE3B 1032/4885PDE3A 579/4885

“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.