SCHEMBL24256

SCHEMBL24256

Cc1cc(C)cc(Nc2nc3c(NCCCN4CCN(C)CC4)nccn3n2)c1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGFR P00533 4/20 0.42
JAK2 O60674 7/20 0.40
JAK1 P23458 4/20 0.40
RAD52 P43351 1/20 0.38
FGFR1 P11362 2/20 0.37
KDR P35968 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
PTK2 Q05397 5/20 0.37
JAK3 P52333 3/20 0.37
PGK1 P00558 1/20 0.37
SRC P12931 1/20 0.36
FGFR2 P21802 1/20 0.36
FGFR4 P22455 1/20 0.36
FGFR3 P22607 1/20 0.36
FLT3 P36888 1/20 0.36
SYK P43405 1/20 0.36

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
SCHEMBL24033 0.91 EGFR (0.51) EGFRJAK2JAK1KDRPTK2
SCHEMBL23523 0.90 LMNA (0.48) EGFRJAK2JAK1LMNAMAPT
SCHEMBL24403 0.88 JAK2 (0.44) JAK2FGFR1KDRMAPTPTK2
SCHEMBL24602 0.87 RAD52 (0.46) EGFRJAK2JAK1RAD52FGFR1
SCHEMBL24074 0.82 JAK2 (0.48) EGFRJAK2KDRPTK2JAK3
SCHEMBL24500 0.82 JAK2 (0.38) JAK2KDRLMNAPTK2JAK3
SCHEMBL23494 0.82 SYK (0.44) EGFRJAK2RAD52KDRPTK2
SCHEMBL23085 0.82 EGFR (0.53) EGFRJAK2JAK1MAPTPTK2
SCHEMBL23452 0.81 SYK (0.45) JAK2KDRPTK2FLT3SYK
SCHEMBL23858 0.79 POLB (0.45) JAK2RAD52FGFR1MAPTPTK2

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-9023851-B2 Triazolopyrazine derivatives MERCK PATENT GMBH (DE) 2015-05-05 US claimed
US-20130225568-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 US claimed
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 EGFR 1974/4885JAK2 5/4885JAK1 13/4885

“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.