SCHEMBL21617

SCHEMBL21617

N#Cc1ccc(-c2nccn3nc(Nc4ccc5nsnc5c4)nc23)cn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.38
EIF2AK4 Q9P2K8 1/20 0.38
CHEK1 O14757 1/20 0.36
JAK2 O60674 5/20 0.34
JAK3 P52333 5/20 0.34
PTK2 Q05397 4/20 0.34
TNF P01375 2/20 0.33
PDE10A Q9Y233 3/20 0.32
PIK3CA P42336 2/20 0.32
PIK3CD O00329 1/20 0.31
ABL1 P00519 1/20 0.31
EGFR P00533 1/20 0.31
HCK P08631 1/20 0.31
SRC P12931 1/20 0.31
KDR P35968 1/20 0.31
PIK3CB P42338 1/20 0.31
MTOR P42345 1/20 0.31
EPHB4 P54760 1/20 0.31
PRKDC P78527 1/20 0.31
PI4KB Q9UBF8 1/20 0.31

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
SCHEMBL15218981 0.86 SYK (0.39) SYKEIF2AK4JAK2JAK3PTK2
SCHEMBL22305 0.86 SYK (0.41) SYKEIF2AK4JAK2JAK3PTK2
SCHEMBL15207185 0.84 SYK (0.37) SYKEIF2AK4CHEK1JAK2JAK3
SCHEMBL15207446 0.84 JAK2 (0.42) SYKEIF2AK4JAK2JAK3PTK2
SCHEMBL19869 0.83 SYK (0.39) SYKEIF2AK4JAK2JAK3PTK2
SCHEMBL21236 0.83 JAK2 (0.45) SYKEIF2AK4JAK2JAK3PTK2
SCHEMBL21199 0.82 SYK (0.41) SYKEIF2AK4JAK2JAK3PTK2
SCHEMBL15207896 0.82 CHEK1 (0.40) SYKEIF2AK4CHEK1JAK2JAK3
SCHEMBL15208049 0.82 JAK2 (0.40) SYKEIF2AK4JAK2JAK3PTK2
SCHEMBL15207711 0.81 PIK3CA (0.45) SYKEIF2AK4JAK2PIK3CA

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 1898/4885CHEK1 1302/4885

“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.