SCHEMBL19982923

SCHEMBL19982923

CN(c1nccn2nc(Nc3ccc4c(c3)NC(O)C4(C)C)nc12)C1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 1/20 0.39
▸ EIF2AK4 Q9P2K8 1/20 0.39
▸ JAK2 O60674 11/20 0.35
▸ JAK1 P23458 9/20 0.35
▸ JAK3 P52333 10/20 0.35
▸ LCK P06239 6/20 0.35
▸ PTK2 Q05397 2/20 0.34

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
SCHEMBL15210790 0.84 SYK (0.46) SYKEIF2AK4JAK2JAK1JAK3
SCHEMBL15210990 0.77 SYK (0.46) SYKEIF2AK4JAK2JAK1JAK3
SCHEMBL15210525 0.76 SYK (0.45) SYKEIF2AK4JAK2JAK1JAK3
SCHEMBL15210559 0.76 SYK (0.44) SYKEIF2AK4JAK2JAK1JAK3
SCHEMBL15212620 0.76 SYK (0.45) SYKEIF2AK4JAK2JAK1JAK3
SCHEMBL19983154 0.75 SYK (0.42) SYKEIF2AK4JAK2JAK1JAK3
SCHEMBL19983166 0.75 SYK (0.40) SYKEIF2AK4JAK2JAK1JAK3
SCHEMBL19982833 0.75 SYK (0.42) SYKEIF2AK4JAK2JAK1JAK3
SCHEMBL19982840 0.75 SYK (0.40) SYKEIF2AK4JAK2JAK1JAK3
SCHEMBL19982960 0.74 SYK (0.36) SYKEIF2AK4JAK2JAK1JAK3

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
EP-2817310-B1 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) 2018-03-21 — — EP disclosed
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