SCHEMBL27313423

SCHEMBL27313423

COc1nc(Nc2ccc(C3CCN(C)CC3)c(C)c2)ncc1C(=O)Nc1ccccc1Br

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LCK P06239 5/20 0.51
▸ KDR P35968 2/20 0.51
▸ MAPK14 Q16539 2/20 0.51
▸ JAK3 P52333 1/20 0.51
▸ TEK Q02763 1/20 0.51
▸ WEE1 P30291 1/20 0.46
▸ SRC P12931 2/20 0.45
▸ FGFR1 P11362 1/20 0.45
▸ ALK Q9UM73 1/20 0.44
▸ SIK1 P57059 2/20 0.44
▸ SIK2 Q9H0K1 2/20 0.44
▸ SIK3 Q9Y2K2 2/20 0.44
▸ MAP4K1 Q92918 2/20 0.44
▸ TNK2 Q07912 1/20 0.43
▸ MAP3K7 O43318 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ MAP2K1 Q02750 1/20 0.43
▸ TTK P33981 2/20 0.42
▸ EGFR P00533 2/20 0.42
▸ FGFR3 P22607 1/20 0.41

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
SCHEMBL30962770 1.00 LCK (0.51) LCKKDRMAPK14JAK3TEK
SCHEMBL27313552 0.91 WEE1 (0.52) LCKKDRMAPK14JAK3TEK
SCHEMBL27313548 0.91 SIK1 (0.50) LCKKDRMAPK14JAK3TEK
SCHEMBL30962865 0.91 SIK1 (0.50) LCKKDRMAPK14JAK3TEK
SCHEMBL30962624 0.91 WEE1 (0.52) LCKKDRMAPK14JAK3TEK
SCHEMBL30962827 0.90 LCK (0.52) LCKKDRMAPK14JAK3TEK
SCHEMBL30962905 0.89 LCK (0.50) LCKKDRMAPK14JAK3TEK
SCHEMBL30962653 0.89 LCK (0.48) LCKKDRMAPK14JAK3TEK
SCHEMBL30962919 0.89 LCK (0.60) LCKKDRMAPK14JAK3TEK
SCHEMBL27313565 0.89 LCK (0.60) LCKKDRMAPK14JAK3TEK

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
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