SCHEMBL19907

SCHEMBL19907

COCCCc1cnc(N)c2nc(Nc3cccc(C(F)(F)F)c3)nn12

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
LMNA P02545 2/20 0.46
MAPK1 P28482 1/20 0.46
IDH2 P48735 8/20 0.44
KDM4E B2RXH2 1/20 0.43
SYK P43405 1/20 0.42
APP P05067 1/20 0.41
CDK2 P24941 3/20 0.41
GSK3B P49841 3/20 0.41
ABCG2 Q9UNQ0 1/20 0.40
BCDIN3D Q7Z5W3 1/20 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
SCHEMBL19614 0.87 IDH2 (0.46) MAPTLMNAMAPK1IDH2KDM4E
SCHEMBL19883 0.87 TP53 (0.42) MAPTLMNASYKCDK2
SCHEMBL20261 0.87 KDM4E (0.47) MAPTLMNAIDH2KDM4ESYK
SCHEMBL20643 0.85 KCNH3 (0.46) LMNAMAPK1
SCHEMBL17908147 0.84 IDH2 (0.46) MAPTLMNAIDH2KDM4E
SCHEMBL19973 0.82 USP2 (0.47) MAPTLMNAGSK3B
SCHEMBL19908 0.79 MAPT (0.44) MAPTLMNAMAPK1IDH2KDM4E
SCHEMBL15206920 0.77 MAPT (0.47) MAPTLMNAMAPK1IDH2KDM4E
SCHEMBL15208059 0.76 KDM4E (0.46) MAPTLMNAMAPK1IDH2KDM4E
SCHEMBL20001 0.74 TNK2 (0.41) MAPTLMNASYKCDK2

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 4687/4885LMNA 4697/4885MAPK1 353/4885

“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.