SCHEMBL16394451

SCHEMBL16394451

N[SH](=O)=O.c1ccc(Nc2nc3c(-c4ccccc4-c4ccccc4)nccn3n2)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 14/20 0.49
JAK3 P52333 12/20 0.49
PTK2 Q05397 6/20 0.43
AURKA O14965 1/20 0.39
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
CYP1A2 P05177 1/20 0.38
CASP1 P29466 1/20 0.38
CYP2C19 P33261 1/20 0.38
CASP7 P55210 1/20 0.38
KMT2A Q03164 1/20 0.38
HIF1A Q16665 1/20 0.38
KDR P35968 1/20 0.37
MERTK Q12866 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
SCHEMBL15212684 0.85 JAK2 (0.53) JAK2JAK3PTK2
SCHEMBL19913 0.83 JAK2 (0.50) JAK2JAK3PTK2AURKAMEN1
SCHEMBL15212854 0.83 JAK2 (0.67) JAK2JAK3PTK2
SCHEMBL15210514 0.83 JAK2 (0.53) JAK2JAK3PTK2AURKAKDR
SCHEMBL15210695 0.83 JAK2 (0.58) JAK2JAK3PTK2KDR
SCHEMBL15221151 0.81 JAK2 (0.46) JAK2JAK3PTK2
SCHEMBL17035576 0.80 JAK2 (0.45) JAK2JAK3PTK2MEN1USP2
SCHEMBL16394411 0.80 SYK (0.55) JAK2JAK3MEN1USP2CYP1A2
SCHEMBL15210810 0.80 JAK2 (0.58) JAK2JAK3PTK2MEN1USP2
SCHEMBL21968 0.80 JAK2 (0.54) JAK2JAK3PTK2KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150025058-A1 8 - SUBSTITUTED 2 -AMINO - [1,2,4] TRIAZOLO [1, 5 -A] PYRAZINES AS SYK TRYROSINE KINASE INHIBITORS AND GCN2 SERIN KINASE INHIBITORS MERCK PATENT GMBH (DE) 2015-01-22 US claimed

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-20150025058-A1 8 - SUBSTITUTED 2 -AMINO - [1,2,4] TRIAZOLO [1, 5 -A] PYRAZINES AS SYK TRYROSINE KINASE INHIBITORS AND GCN2 SERIN KINASE INHIBITORS SYK, EIF2AK4, BTK JAK2 29/4885JAK3 127/4885PTK2 48/4885

“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.