SCHEMBL25048560

SCHEMBL25048560

CS(=O)(=O)n1ccc(-c2cn([C@@H]3C[C@H](CNCCCNCCc4ccccc4)[C@@H](O)[C@H]3O)c3ncncc23)n1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 16/20 0.38
▸ CA2 P00918 1/20 0.35
▸ METTL3 Q86U44 5/20 0.34
▸ WDR77 Q9BQA1 5/20 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
SCHEMBL30941616 1.00 PRMT5 (0.38) PRMT5CA2METTL3WDR77
SCHEMBL25048866 0.92 PRMT5 (0.37) PRMT5CA2METTL3WDR77
SCHEMBL30941145 0.92 PRMT5 (0.37) PRMT5CA2METTL3WDR77
SCHEMBL25048434 0.89 PRMT5 (0.34) PRMT5CA2METTL3WDR77
SCHEMBL25047829 0.87 METTL3 (0.48) PRMT5CA2METTL3WDR77
SCHEMBL30941581 0.87 METTL3 (0.48) PRMT5CA2METTL3WDR77
SCHEMBL25048518 0.82 PRMT5 (0.40) PRMT5CA2METTL3WDR77
SCHEMBL30941156 0.82 PRMT5 (0.40) PRMT5CA2METTL3WDR77
SCHEMBL30940860 0.81 PRMT5 (0.41) PRMT5METTL3WDR77
SCHEMBL30941241 0.80 METTL3 (0.46) PRMT5CA2METTL3WDR77

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
Send feedback