SCHEMBL25047729

SCHEMBL25047729

C/C=C(\C=C/N)C1CC(n2ccc3c(N)ncnc32)C[C@@H]1OC(C)(C)O

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 17/20 0.40
▸ WDR77 Q9BQA1 13/20 0.40
▸ ADK P55263 1/20 0.35
▸ METTL3 Q86U44 1/20 0.33

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
SCHEMBL25047772 0.78 PRMT5 (0.31) PRMT5WDR77
SCHEMBL25048272 0.77 PRMT5 (0.40) PRMT5WDR77ADK
SCHEMBL25047453 0.75 PRMT5 (0.40) PRMT5WDR77ADKMETTL3
SCHEMBL21312931 0.70 PRMT5 (0.40) PRMT5WDR77METTL3
SCHEMBL21312978 0.69 PRMT5 (0.41) PRMT5WDR77METTL3
SCHEMBL24067669 0.69 PRMT5 (0.34) PRMT5WDR77
SCHEMBL24090715 0.68 PRMT5 (0.43) PRMT5WDR77ADK
SCHEMBL25049137 0.67 NNMT (0.36) PRMT5WDR77
SCHEMBL24067682 0.67 PRMT5 (0.42) PRMT5WDR77METTL3
SCHEMBL22002179 0.67 PRMT5 (0.42) PRMT5WDR77ADKMETTL3

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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