SCHEMBL20549

SCHEMBL20549

Cc1cc(C)cc(Nc2nc3c(-c4cccc(C(=O)NCCN(C)C)c4)nccn3n2)c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SYK P43405 3/20 0.49
FLT3 P36888 2/20 0.49
PTK2 Q05397 2/20 0.46
JAK1 P23458 3/20 0.46
CAMK2D Q13557 3/20 0.45
TP53 P04637 1/20 0.45
CCNT1 O60563 1/20 0.44
CCNE1 P24864 1/20 0.44
CDK2 P24941 1/20 0.44
CDK9 P50750 1/20 0.44
MAPK8 P45983 1/20 0.44
MAPK10 P53779 1/20 0.44
MAPK14 Q16539 1/20 0.44
FYN P06241 4/20 0.43
CDC7 O00311 1/20 0.43
CDK19 Q9BWU1 1/20 0.43
MAP4K4 O95819 1/20 0.43
JAK2 O60674 1/20 0.42

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
SCHEMBL15208070 0.95 SYK (0.50) SYKFLT3PTK2JAK1CAMK2D
SCHEMBL15207564 0.90 PTK2 (0.50) SYKPTK2JAK1CAMK2DCCNT1
SCHEMBL20941 0.85 FYN (0.51) SYKPTK2MAPK8FYNJAK2
SCHEMBL21149 0.83 SYK (0.46) SYKFYN
SCHEMBL15207265 0.82 MAP4K4 (0.42) SYKJAK1MAP4K4JAK2
SCHEMBL21230 0.78 KDR (0.43) SYKJAK2
SCHEMBL20010 0.77 KDR (0.52) SYKTP53JAK2
SCHEMBL15207171 0.76 KDR (0.41) SYKPTK2JAK2
SCHEMBL3213399 0.75 JAK1 (0.64) PTK2JAK1JAK2
SCHEMBL20253 0.74 KDR (0.54) SYKPTK2TP53JAK2

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 7 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
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 1/4885FLT3 16/4885PTK2 367/4885

“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.