SCHEMBL25048546

SCHEMBL25048546

O[C@@H]1[C@@H](CNCCCNCCc2ccccc2)C[C@@H](n2cc(-c3nc(Cc4ccccc4)cs3)c3cnc(Cl)nc32)[C@@H]1O

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 4/20 0.35
▸ CA2 P00918 1/20 0.32
▸ METTL3 Q86U44 1/20 0.30

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
SCHEMBL30940844 0.89 PRMT5 (0.40) PRMT5CA2METTL3
SCHEMBL25048867 0.89 PRMT5 (0.40) PRMT5CA2METTL3
SCHEMBL30941105 0.89 PRMT5 (0.36) PRMT5CA2
SCHEMBL25048561 0.89 PRMT5 (0.36) PRMT5CA2
SCHEMBL25048805 0.88 CA2 (0.35) PRMT5CA2METTL3
Hydrochloric Acid SCHEMBL30940743 0.87 CA2 (0.34) PRMT5CA2METTL3
SCHEMBL25048295 0.85 PRMT5 (0.33) PRMT5CA2METTL3
SCHEMBL30941450 0.84 CA2 (0.44) PRMT5CA2METTL3
SCHEMBL25048519 0.84 CA2 (0.44) PRMT5CA2METTL3
SCHEMBL25048042 0.81 CNR1 (0.33) PRMT5

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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