SCHEMBL22123044

SCHEMBL22123044

CCc1cc(Nc2nccn3c(-c4ccc(OC)c(F)c4F)cnc23)ccc1C(=O)NCCC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 6/20 0.36
▸ PTK6 Q13882 1/20 0.36
▸ PDE4B Q07343 2/20 0.35
▸ PDE4D Q08499 2/20 0.35
▸ SYK P43405 3/20 0.34
▸ AXL P30530 1/20 0.34
▸ GCGR P47871 3/20 0.34
▸ MAPKAPK5 Q8IW41 1/20 0.34
▸ EGLN1 Q9GZT9 3/20 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
SCHEMBL22123542 0.94 TTK (0.35) TTKPTK6PDE4BPDE4DSYK
SCHEMBL24870783 0.93 TTK (0.37) TTKPTK6PDE4BPDE4DSYK
SCHEMBL22124780 0.93 TTK (0.34) TTKPTK6PDE4BPDE4DSYK
SCHEMBL22124809 0.93 PTK6 (0.37) TTKPTK6PDE4BPDE4DSYK
SCHEMBL22124866 0.92 TTK (0.34) TTKPTK6PDE4BPDE4DSYK
SCHEMBL22124841 0.92 TTK (0.34) TTKPTK6PDE4BPDE4DSYK
SCHEMBL22160896 0.92 PTK6 (0.36) TTKPTK6SYKAXLMAPKAPK5
SCHEMBL22122926 0.92 SYK (0.38) TTKPTK6SYKAXLMAPKAPK5
SCHEMBL24112454 0.92 PTK6 (0.36) TTKPTK6PDE4BPDE4DSYK
SCHEMBL22124859 0.92 TTK (0.34) TTKPTK6PDE4BPDE4DSYK

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3897840-A1 IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIAL AGENTS F. Hoffmann-La Roche AG (CH) 2021-10-27 — — EP disclosed
EP-3898631-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS F. Hoffmann-La Roche AG (CH) 2021-10-27 — — EP disclosed
EP-3898629-A1 IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS F. Hoffmann-La Roche AG (CH) 2021-10-27 — — EP disclosed
EP-3898630-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2021-10-27 — — EP disclosed
EP-3897839-A1 IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIAL AGENTS F. Hoffmann-La Roche AG (CH) 2021-10-27 — — EP disclosed
WO-2020126954-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2020-06-25 — — WO disclosed
WO-2020127075-A1 IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS F. HOFFMANN-LA ROCHE AG (CH) 2020-06-25 — — WO disclosed
WO-2020126952-A1 IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2020-06-25 — — WO disclosed
WO-2020126956-A1 IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2020-06-25 — — WO disclosed
WO-2020126953-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS F. HOFFMANN-LA ROCHE AG (CH) 2020-06-25 — — WO disclosed
Send feedback