SCHEMBL24767

SCHEMBL24767

COc1cc(Nc2nc3c(Nc4ccc(Sc5nccn5C)c(Cl)c4)nccn3n2)cc(OC)c1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 8/20 0.47
MAP2K1 Q02750 12/20 0.43
MAPK3 P27361 1/20 0.40
MAPK1 P28482 1/20 0.40
MAP3K1 Q13233 1/20 0.40
BRD4 O60885 1/20 0.39
EGFR P00533 1/20 0.38
ERBB2 P04626 1/20 0.38
NPC1 O15118 1/20 0.37
POLB P06746 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL24060 1.00 IGF1R (0.47) IGF1RMAP2K1MAPK3MAPK1MAP3K1
SCHEMBL23678 0.90 IGF1R (0.44) IGF1RMAP2K1
SCHEMBL23542 0.88 IGF1R (0.46) IGF1RMAP2K1MAPK3MAPK1MAP3K1
SCHEMBL15216751 0.88 IGF1R (0.44) IGF1RMAP2K1
SCHEMBL15216750 0.85 NPC1 (0.45) IGF1RMAP2K1NPC1RAB9A
SCHEMBL23434 0.84 IGF1R (0.46) IGF1RMAP2K1
SCHEMBL15208567 0.83 IGF1R (0.43) IGF1RMAP2K1EGFR
SCHEMBL24518 0.83 GCK (0.44) IGF1RMAP2K1EGFRERBB2
SCHEMBL24626 0.82 IGF1R (0.37) IGF1RMAP2K1NPC1RAB9A
SCHEMBL15206957 0.80 IGF1R (0.38) IGF1RMAP2K1MAPK3MAPK1MAP3K1

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 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 IGF1R 101/4885MAP2K1 987/4885MAPK3 836/4885

“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.