SCHEMBL16394366

SCHEMBL16394366

CC1(C)C(=O)Nc2cc(Nc3nc4c(N5CCC(S(=O)(=O)O)CC5)nccn4n3)ccc21

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.48
EIF2AK4 Q9P2K8 1/20 0.48
JAK2 O60674 16/20 0.37
JAK3 P52333 10/20 0.37
CAMK1D Q8IU85 1/20 0.37
JAK1 P23458 7/20 0.37
PTK2 Q05397 9/20 0.36
CYP3A4 P08684 1/20 0.36
LCK P06239 1/20 0.36
BRAF P15056 1/20 0.36
KDR P35968 1/20 0.36
MAPK14 Q16539 1/20 0.36
TBK1 Q9UHD2 1/20 0.35

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
SCHEMBL16394844 0.94 SYK (0.45) SYKEIF2AK4JAK2JAK3CAMK1D
SCHEMBL15210519 0.93 SYK (0.45) SYKEIF2AK4JAK2JAK3CAMK1D
SCHEMBL16394518 0.89 SYK (0.48) SYKEIF2AK4JAK2CAMK1DJAK1
SCHEMBL15210740 0.89 SYK (0.51) SYKEIF2AK4JAK2JAK3CAMK1D
SCHEMBL15210555 0.89 SYK (0.47) SYKEIF2AK4JAK2JAK3CAMK1D
SCHEMBL15210800 0.88 SYK (0.48) SYKEIF2AK4JAK2JAK3CAMK1D
SCHEMBL15210609 0.88 SYK (0.48) SYKEIF2AK4JAK2JAK3CAMK1D
SCHEMBL15210604 0.88 SYK (0.48) SYKEIF2AK4JAK2JAK3CAMK1D
SCHEMBL15212586 0.88 SYK (0.50) SYKEIF2AK4JAK2JAK3CAMK1D
SCHEMBL16394673 0.88 SYK (0.50) SYKEIF2AK4JAK2JAK3CAMK1D

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 SYK 1/4885EIF2AK4 2/4885JAK2 29/4885

“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.