SCHEMBL15216767

SCHEMBL15216767

c1ccc2ncc(-c3nccn4nc(Nc5ccc(N6CCOCC6)cc5)nc34)cc2c1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.57
JAK2 O60674 8/20 0.56
JAK3 P52333 7/20 0.56
PTK2 Q05397 6/20 0.56
HSP90AA1 P07900 1/20 0.47
AURKA O14965 1/20 0.46
STAT6 P42226 2/20 0.46
KIT P10721 1/20 0.46
FLT3 P36888 1/20 0.46
SLC2A1 P11166 1/20 0.46
PLK4 O00444 1/20 0.45
AXL P30530 1/20 0.45
KDM1A O60341 1/20 0.43
INSR P06213 1/20 0.43

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
SCHEMBL21170 0.90 IGF1R (0.48) IGF1RJAK2JAK3PTK2
SCHEMBL24181 0.90 JAK2 (0.56) JAK2JAK3PTK2
SCHEMBL20200 0.88 PTGS2 (0.49) IGF1RJAK2JAK3PTK2
SCHEMBL15221135 0.86 JAK2 (0.53) IGF1RJAK2JAK3PTK2AURKA
SCHEMBL20504 0.85 JAK2 (0.74) JAK2JAK3PTK2AURKA
SCHEMBL20266 0.84 JAK2 (0.55) IGF1RJAK2JAK3PTK2AURKA
SCHEMBL20513 0.83 JAK2 (0.55) JAK2JAK3PTK2AURKAKIT
SCHEMBL21597 0.82 JAK2 (0.59) JAK2JAK3PTK2AURKA
SCHEMBL20114 0.82 JAK2 (0.66) JAK2JAK3PTK2AURKASTAT6
SCHEMBL20495 0.81 TTK (0.57) JAK2JAK3PTK2AURKA

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 5 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-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

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 IGF1R 101/4885JAK2 5/4885JAK3 32/4885

“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.