SCHEMBL25048522

SCHEMBL25048522

CCc1cn([C@@H]2C[C@H](CNCCCNCCc3ccccc3)[C@@H](O)[C@H]2O)c2ncnc(C)c12

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 9/20 0.39
▸ PRMT5 O14744 6/20 0.37
▸ CA2 P00918 2/20 0.37
▸ ADORA3 P0DMS8 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
SCHEMBL30941404 1.00 METTL3 (0.39) METTL3PRMT5CA2ADORA3
SCHEMBL31618064 0.91 METTL3 (0.49) METTL3PRMT5CA2
SCHEMBL30941392 0.91 METTL3 (0.49) METTL3PRMT5CA2
SCHEMBL25048822 0.91 METTL3 (0.49) METTL3PRMT5CA2
SCHEMBL25048505 0.91 CA2 (0.40) METTL3PRMT5CA2ADORA3
SCHEMBL30941220 0.89 METTL3 (0.45) METTL3PRMT5CA2
SCHEMBL25048513 0.87 METTL3 (0.38) METTL3PRMT5CA2ADORA3
SCHEMBL30940869 0.87 METTL3 (0.38) METTL3PRMT5CA2ADORA3
SCHEMBL25048518 0.85 PRMT5 (0.40) METTL3PRMT5CA2
SCHEMBL30941156 0.85 PRMT5 (0.40) METTL3PRMT5CA2

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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