SCHEMBL24910344

SCHEMBL24910344

C=C(c1ccc(Nc2nccn3c(-c4ccc(OC)c(F)c4F)cnc23)cc1C)N1CCN(C(=O)[C@@H]2CCCN2)CC1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 8/20 0.40
▸ AURKB Q96GD4 4/20 0.38
▸ TTK P33981 6/20 0.37
▸ MAPKAPK5 Q8IW41 1/20 0.36
▸ SYK P43405 2/20 0.35
▸ LCK P06239 3/20 0.34
▸ AXL P30530 2/20 0.34
▸ TYRO3 Q06418 1/20 0.34
▸ MERTK Q12866 1/20 0.34
▸ PTK2 Q05397 1/20 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
SCHEMBL22139092 0.94 PTK6 (0.45) PTK6AURKBTTKMAPKAPK5LCK
SCHEMBL22139168 0.94 PTK6 (0.45) PTK6AURKBTTKMAPKAPK5LCK
SCHEMBL22139240 0.94 PTK6 (0.45) PTK6AURKBTTKMAPKAPK5LCK
SCHEMBL24940120 0.90 TTK (0.44) PTK6AURKBTTKMAPKAPK5AXL
SCHEMBL24940104 0.89 TTK (0.42) PTK6AURKBTTKSYKAXL
SCHEMBL24910582 0.89 PTK6 (0.36) PTK6AURKBTTKMAPKAPK5SYK
SCHEMBL24910502 0.89 PTK6 (0.46) PTK6AURKBLCK
SCHEMBL22139081 0.88 PTK6 (0.54) PTK6AURKBLCK
SCHEMBL22154507 0.88 PTK6 (0.54) PTK6AURKBLCK
SCHEMBL22139096 0.88 PTK6 (0.44) PTK6AURKBMAPKAPK5LCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3898630-B1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2023-05-10 — — EP disclosed
EP-3898629-B1 IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS HOFFMANN LA ROCHE (CH) 2023-01-18 — — EP disclosed
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