SCHEMBL23315918

SCHEMBL23315918

N#Cc1cc(-c2ncnc(Nc3ccc(N4CCOCC4)cc3)n2)ccc1NC(=O)C1CCCCCC1

nearest known ligand 0.92

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TBK1 Q9UHD2 20/20 0.92
JAK2 O60674 13/20 0.92

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
SCHEMBL17631115 0.96 TBK1 (1.00) TBK1JAK2
SCHEMBL23315998 0.89 TBK1 (0.96) TBK1JAK2
SCHEMBL17630805 0.89 TBK1 (1.00) TBK1JAK2
SCHEMBL17630808 0.89 TBK1 (1.00) TBK1JAK2
SCHEMBL12522340 0.88 JAK2 (0.71) TBK1JAK2
SCHEMBL12275181 0.87 JAK2 (0.72) TBK1JAK2
SCHEMBL12521805 0.85 JAK2 (0.72) TBK1JAK2
SCHEMBL17630296 0.85 TBK1 (0.73) TBK1JAK2
SCHEMBL17630298 0.85 TBK1 (0.73) TBK1JAK2
SCHEMBL21204657 0.84 TBK1 (0.78) TBK1JAK2

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-3517536-B1 AMINOTRIAZINE DERIVATIVES USEFUL AS TANK-BINDING KINASE INHIBITOR COMPOUNDS GILEAD SCIENCES INC (US) 2021-05-05 EP disclosed