SCHEMBL25048397

SCHEMBL25048397

CNc1ncnc2c1c(Br)cn2[C@@H]1C[C@H](CNCCCNCCc2cccc(Oc3ccccc3)c2)[C@@H](O)[C@H]1O

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 14/20 0.43
▸ PRMT5 O14744 6/20 0.38
▸ ADORA3 P0DMS8 1/20 0.35
▸ WDR77 Q9BQA1 1/20 0.35

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
SCHEMBL30941154 1.00 METTL3 (0.43) METTL3PRMT5ADORA3WDR77
SCHEMBL25048398 0.90 METTL3 (0.54) METTL3PRMT5
SCHEMBL30941227 0.90 METTL3 (0.54) METTL3PRMT5
SCHEMBL31618087 0.87 PRMT5 (0.49) METTL3PRMT5WDR77
SCHEMBL25048258 0.87 PRMT5 (0.49) METTL3PRMT5WDR77
SCHEMBL25048394 0.83 METTL3 (0.47) METTL3PRMT5
SCHEMBL30940736 0.83 METTL3 (0.47) METTL3PRMT5
SCHEMBL25048399 0.82 LCK (0.51) METTL3
SCHEMBL30940977 0.82 LCK (0.51) METTL3
SCHEMBL30941220 0.82 METTL3 (0.45) METTL3PRMT5

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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