SCHEMBL24074

SCHEMBL24074

CN1CCN(CCCNc2nccn3nc(Nc4cccc(C(F)(F)F)c4)nc23)CC1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 10/20 0.48
PTK2 Q05397 10/20 0.48
JAK3 P52333 8/20 0.48
DRD2 P14416 1/20 0.46
ADRA1A P35348 1/20 0.46
DRD3 P35462 1/20 0.46
HRH4 Q9H3N8 1/20 0.46
INSR P06213 3/20 0.45
LCK P06239 3/20 0.45
LYN P07948 3/20 0.45
HCK P08631 3/20 0.45
SRC P12931 3/20 0.45
KDR P35968 3/20 0.45
EGFR P00533 1/20 0.44
IDH2 P48735 1/20 0.44
CTSC P53634 3/20 0.44
USP2 O75604 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL24502 0.91 SLC6A2 (0.51) JAK2PTK2JAK3DRD2ADRA1A
SCHEMBL24033 0.88 EGFR (0.51) JAK2PTK2JAK3INSRLCK
SCHEMBL24602 0.86 RAD52 (0.46) JAK2PTK2JAK3KDREGFR
SCHEMBL15207316 0.84 KDM4E (0.44) JAK2PTK2JAK3KDRIDH2
SCHEMBL15207975 0.84 SYK (0.46) INSRLCKLYNHCKSRC
SCHEMBL24321 0.83 CDK1 (0.55) JAK2PTK2JAK3KDRIDH2
SCHEMBL24256 0.82 EGFR (0.42) JAK2PTK2JAK3SRCKDR
SCHEMBL23696 0.80 AURKA (0.52) JAK2PTK2JAK3KDRIDH2
SCHEMBL24403 0.80 JAK2 (0.44) JAK2PTK2JAK3KDR
SCHEMBL23085 0.79 EGFR (0.53) JAK2PTK2JAK3EGFR

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
US-20130225568-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 US 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-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
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 JAK2 5/4885PTK2 367/4885JAK3 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.