SCHEMBL25048258

SCHEMBL25048258

CNc1ncnc2c1ccn2[C@@H]1C[C@H](CNCCCNCCc2cccc(Oc3ccccc3)c2)[C@@H](O)[C@H]1O

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 18/20 0.49
▸ WDR77 Q9BQA1 7/20 0.48
▸ METTL3 Q86U44 2/20 0.43

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
SCHEMBL31618087 1.00 PRMT5 (0.49) PRMT5WDR77METTL3
SCHEMBL25048328 0.92 PRMT5 (0.55) PRMT5WDR77METTL3
SCHEMBL31618052 0.92 PRMT5 (0.55) PRMT5WDR77METTL3
SCHEMBL30941533 0.91 PRMT5 (0.47) PRMT5WDR77METTL3
SCHEMBL25046802 0.91 PRMT5 (0.54) PRMT5WDR77METTL3
SCHEMBL25046813 0.90 PRMT5 (0.47) PRMT5WDR77METTL3
SCHEMBL30941626 0.89 PRMT5 (0.40) PRMT5WDR77METTL3
SCHEMBL25048963 0.89 PRMT5 (0.40) PRMT5WDR77METTL3
SCHEMBL25047776 0.89 PRMT5 (0.54) PRMT5WDR77METTL3
SCHEMBL25046812 0.89 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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