SCHEMBL19983154

SCHEMBL19983154

CC1(C)c2ccc(Nc3nc4c(N5CCC(F)(F)C5)nccn4n3)cc2NC1O

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 3/20 0.42
▸ EIF2AK4 Q9P2K8 1/20 0.42
▸ GRM4 Q14833 3/20 0.36
▸ JAK2 O60674 10/20 0.35
▸ JAK1 P23458 10/20 0.35
▸ JAK3 P52333 2/20 0.34
▸ ABL1 P00519 1/20 0.33
▸ TTK P33981 1/20 0.33
▸ PTK2 Q05397 1/20 0.32

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
SCHEMBL19982840 0.86 SYK (0.40) SYKEIF2AK4JAK2JAK1JAK3
SCHEMBL15210658 0.84 SYK (0.49) SYKEIF2AK4GRM4JAK2JAK1
SCHEMBL19982833 0.83 SYK (0.42) SYKEIF2AK4JAK2JAK1JAK3
SCHEMBL19983166 0.82 SYK (0.40) SYKEIF2AK4JAK2JAK1JAK3
SCHEMBL19982813 0.82 SYK (0.43) SYKEIF2AK4JAK2JAK1JAK3
SCHEMBL19982766 0.80 SYK (0.37) SYKEIF2AK4JAK2JAK1JAK3
SCHEMBL19982784 0.78 SYK (0.39) SYKEIF2AK4JAK2JAK1
SCHEMBL19982960 0.78 SYK (0.36) SYKEIF2AK4JAK2JAK1JAK3
SCHEMBL19982923 0.75 SYK (0.39) SYKEIF2AK4JAK2JAK1JAK3
SCHEMBL15210848 0.75 SYK (0.49) 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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