SCHEMBL19190

SCHEMBL19190

Cc1cccc(Nc2nc3c(N)ncc(CCCN4CCN(C)CC4)n3n2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.44
HTT P42858 2/20 0.44
EGFR P00533 2/20 0.43
USP2 O75604 4/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
JAK2 O60674 2/20 0.40
JAK3 P52333 2/20 0.40
SLC2A1 P11166 1/20 0.40
POLB P06746 1/20 0.40
SLC29A2 Q14542 1/20 0.40
SLC29A1 Q99808 1/20 0.40
TNK2 Q07912 2/20 0.40
SRC P12931 2/20 0.40
PDGFRB P09619 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NOS3 P29474 1/20 0.39
NOS1 P29475 1/20 0.39
NOS2 P35228 1/20 0.39
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL18859 0.91 MAPT (0.47) MAPTEGFRUSP2POLBTNK2
SCHEMBL15206842 0.90 TNK2 (0.47) MAPTEGFRL3MBTL1JAK2JAK3
SCHEMBL17908147 0.88 IDH2 (0.46) MAPTEGFRUSP2JAK2JAK3
SCHEMBL21783 0.83 AURKA (0.43) MAPTHTTJAK2SLC2A1SRC
SCHEMBL20001 0.83 TNK2 (0.41) MAPTHTTEGFRUSP2JAK2
SCHEMBL19883 0.83 TP53 (0.42) MAPTHTTUSP2JAK2SLC2A1
SCHEMBL21245 0.79 MEN1 (0.50) MAPTHTTPOLBTNK2LMNA
SCHEMBL19191 0.79 NOS3 (0.44) MAPTHTTEGFRUSP2L3MBTL1
SCHEMBL19973 0.78 USP2 (0.47) MAPTEGFRUSP2JAK2JAK3
SCHEMBL15207753 0.73 SYK (0.36) JAK2SRCSMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2609098-B1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2016-07-13 EP claimed
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-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 MAPT 4687/4885HTT 4261/4885EGFR 1974/4885

“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.