SCHEMBL25048541

SCHEMBL25048541

CC1(C)O[C@@H]2[C@@H](CNCCCNCCc3ccccc3)C[C@@H](n3cc(C4CCOCC4)c4c(N)ncnc43)[C@@H]2O1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 16/20 0.46
▸ LCK P06239 2/20 0.34
▸ SRC P12931 2/20 0.34
▸ TEK Q02763 2/20 0.34
▸ HCK P08631 1/20 0.34
▸ PRMT5 O14744 3/20 0.33
▸ WDR77 Q9BQA1 1/20 0.33
▸ WDR5 P61964 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ RBBP5 Q15291 1/20 0.31
▸ DPY30 Q9C005 1/20 0.31
▸ ASH2L Q9UBL3 1/20 0.31
▸ RIPK2 O43353 1/20 0.31

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
SCHEMBL30941705 0.86 METTL3 (0.57) METTL3PRMT5
SCHEMBL25048886 0.86 METTL3 (0.57) METTL3PRMT5
SCHEMBL30940999 0.81 METTL3 (0.52) METTL3PRMT5
SCHEMBL25046807 0.81 METTL3 (0.52) METTL3PRMT5
SCHEMBL30941129 0.78 METTL3 (0.49) METTL3PRMT5WDR77
SCHEMBL25048887 0.78 METTL3 (0.49) METTL3PRMT5WDR77
SCHEMBL30940806 0.76 METTL3 (0.47) METTL3PRMT5WDR77
SCHEMBL25048880 0.76 METTL3 (0.47) METTL3PRMT5WDR77
SCHEMBL25047518 0.75 ABL1 (0.44) METTL3LCKSRCTEKPRMT5
SCHEMBL30940930 0.73 METTL3 (0.49) METTL3LCKSRCTEKPRMT5

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-2023017152-A1 SPECIFIC SMALL MOLECULE INHIBITORS THAT BLOCK KMT9 METHYLTRANSFERASE ACTIVITY AND FUNCTION ALBERT-LUDWIGS-UNIVERSITÄT FREIBURG (DE) 2023-02-16 — — WO disclosed
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