SCHEMBL30385354

SCHEMBL30385354

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

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 5/20 0.36
▸ MAPKAPK5 Q8IW41 1/20 0.35
▸ AXL P30530 2/20 0.34
▸ PTK6 Q13882 1/20 0.34
▸ TTK P33981 4/20 0.33
▸ BRAF P15056 1/20 0.33
▸ MTOR P42345 1/20 0.33
▸ PDE10A Q9Y233 1/20 0.32
▸ IDO1 P14902 1/20 0.32
▸ GPR52 Q9Y2T5 1/20 0.32
▸ PDE4B Q07343 1/20 0.32
▸ PDE4D Q08499 1/20 0.32
▸ ZAP70 P43403 1/20 0.32
▸ KARS1 Q15046 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
SCHEMBL22123578 1.00 SYK (0.36) SYKMAPKAPK5AXLPTK6TTK
SCHEMBL22124597 0.99 SYK (0.37) SYKMAPKAPK5AXLPTK6TTK
Hydrochloric Acid SCHEMBL25173409 0.99 SYK (0.35) SYKMAPKAPK5AXLPTK6TTK
Hydrochloric Acid SCHEMBL22123465 0.99 SYK (0.36) SYKMAPKAPK5AXLPTK6TTK
SCHEMBL22123340 0.95 SYK (0.35) SYKMAPKAPK5AXLPTK6TTK
SCHEMBL24977978 0.95 MAPKAPK5 (0.35) SYKMAPKAPK5AXLPTK6TTK
SCHEMBL24112091 0.94 PTK6 (0.36) SYKMAPKAPK5AXLPTK6TTK
SCHEMBL22124871 0.94 SYK (0.39) SYKMAPKAPK5AXLPTK6TTK
SCHEMBL22124653 0.94 SYK (0.39) SYKMAPKAPK5AXLPTK6TTK
SCHEMBL22122926 0.94 SYK (0.38) SYKMAPKAPK5AXLPTK6TTK

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-4161931-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2023-04-12 — — EP disclosed
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