SCHEMBL27313554

SCHEMBL27313554

COc1nc(Nc2ccc(C3CCN(C)CC3)c(C)c2)ncc1C(=O)Nc1c(Cl)cccc1Br

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ WEE1 P30291 2/20 0.51
▸ SRC P12931 9/20 0.46
▸ SIK1 P57059 2/20 0.45
▸ SIK2 Q9H0K1 2/20 0.45
▸ SIK3 Q9Y2K2 2/20 0.45
▸ LCK P06239 2/20 0.44
▸ KDR P35968 1/20 0.44
▸ JAK3 P52333 1/20 0.44
▸ TEK Q02763 1/20 0.44
▸ MAPK14 Q16539 1/20 0.44
▸ TNK2 Q07912 1/20 0.44
▸ HCK P08631 1/20 0.43
▸ FGFR1 P11362 1/20 0.43
▸ MAP4K1 Q92918 1/20 0.41
▸ BRD4 O60885 1/20 0.41
▸ MET P08581 1/20 0.40
▸ PTK2 Q05397 1/20 0.40

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
SCHEMBL30962787 1.00 WEE1 (0.51) WEE1SRCSIK1SIK2SIK3
SCHEMBL30962751 0.97 WEE1 (0.48) WEE1SRCSIK1SIK2SIK3
SCHEMBL30962620 0.97 WEE1 (0.48) WEE1SRCSIK1SIK2SIK3
SCHEMBL30962615 0.97 WEE1 (0.48) WEE1SRCSIK1SIK2SIK3
SCHEMBL30962914 0.96 WEE1 (0.46) WEE1SRCSIK1SIK2SIK3
SCHEMBL30962635 0.96 WEE1 (0.46) WEE1SRCSIK1SIK2SIK3
SCHEMBL30962935 0.96 WEE1 (0.46) WEE1SRCSIK1SIK2SIK3
SCHEMBL27313416 0.95 WEE1 (0.54) WEE1SRCSIK1SIK2SIK3
SCHEMBL30962585 0.94 SRC (0.44) WEE1SRCSIK1SIK2SIK3
SCHEMBL30962865 0.93 SIK1 (0.50) WEE1SRCSIK1SIK2SIK3

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
WO-2024145505-A1 PYRIMIDINE CARBOXAMIDE COMPOUNDS ACRIVON THERAPEUTICS, INC. (US) 2024-07-04 — — WO disclosed
Send feedback