SCHEMBL19982783

SCHEMBL19982783

CC1(C)C(=O)Nc2cc(Nc3nc4c(N5CCC(C(=O)[C@@H]6CNC(=O)C6)C5)nccn4n3)ccc21

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 3/20 0.43
▸ EIF2AK4 Q9P2K8 1/20 0.43
▸ JAK2 O60674 12/20 0.36
▸ JAK1 P23458 11/20 0.36
▸ CAMK1D Q8IU85 1/20 0.35
▸ TBK1 Q9UHD2 1/20 0.34
▸ MALT1 Q9UDY8 2/20 0.33
▸ JAK3 P52333 2/20 0.33
▸ PTK2 Q05397 2/20 0.33

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
SCHEMBL15212878 0.89 SYK (0.47) SYKEIF2AK4JAK2JAK1CAMK1D
SCHEMBL15221165 0.88 SYK (0.46) SYKEIF2AK4JAK2JAK1CAMK1D
SCHEMBL15210618 0.88 SYK (0.46) SYKEIF2AK4JAK2JAK1CAMK1D
SCHEMBL15210838 0.87 SYK (0.45) SYKEIF2AK4JAK2JAK1CAMK1D
SCHEMBL16394518 0.86 SYK (0.48) SYKEIF2AK4JAK2JAK1CAMK1D
SCHEMBL15210555 0.85 SYK (0.47) SYKEIF2AK4JAK2JAK1CAMK1D
SCHEMBL15210609 0.85 SYK (0.48) SYKEIF2AK4JAK2JAK1CAMK1D
SCHEMBL15210604 0.85 SYK (0.48) SYKEIF2AK4JAK2JAK1CAMK1D
SCHEMBL15210800 0.85 SYK (0.48) SYKEIF2AK4JAK2JAK1CAMK1D
SCHEMBL16394671 0.84 SYK (0.46) SYKEIF2AK4JAK2JAK1CAMK1D

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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