SCHEMBL25048425

SCHEMBL25048425

CNc1ncnc2c1ccn2[C@@H]1C[C@H](CN(C[C@H]2CCCNC2)c2cncs2)[C@@H](O)[C@H]1O

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 16/20 0.39
▸ WDR77 Q9BQA1 11/20 0.39
▸ METTL3 Q86U44 2/20 0.36
▸ NNMT P40261 1/20 0.34
▸ DOT1L Q8TEK3 1/20 0.34

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
SCHEMBL30940791 1.00 PRMT5 (0.39) PRMT5WDR77METTL3NNMTDOT1L
SCHEMBL25048837 0.83 PRMT5 (0.41) PRMT5WDR77METTL3
SCHEMBL30940916 0.82 PRMT5 (0.46) PRMT5WDR77METTL3
SCHEMBL30941564 0.82 PRMT5 (0.46) PRMT5WDR77METTL3
SCHEMBL25048883 0.82 PRMT5 (0.46) PRMT5WDR77METTL3
SCHEMBL25048831 0.78 PRMT5 (0.46) PRMT5WDR77METTL3
SCHEMBL30941073 0.78 PRMT5 (0.46) PRMT5WDR77METTL3
SCHEMBL25047812 0.75 ADORA3 (0.42) PRMT5WDR77
SCHEMBL30941021 0.75 PRMT5 (0.43) PRMT5WDR77METTL3
SCHEMBL25047936 0.71 PRMT5 (0.46) PRMT5WDR77METTL3

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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