SCHEMBL25048366

SCHEMBL25048366

CCN(CCCNCCc1ccc2ccccc2c1)CC1CCC(n2ccc3c(NC)ncnc32)C1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 11/20 0.37
▸ WDR77 Q9BQA1 6/20 0.36
▸ METTL3 Q86U44 1/20 0.34
▸ BCHE P06276 1/20 0.34
▸ PIP4K2A P48426 1/20 0.33
▸ ADORA3 P0DMS8 1/20 0.33
▸ ADORA2A P29274 1/20 0.33
▸ ADORA1 P30542 1/20 0.33
▸ CCNC P24863 1/20 0.31
▸ CDK8 P49336 1/20 0.31
▸ GAA P10253 1/20 0.31

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
SCHEMBL25047713 0.87 PRMT5 (0.41) PRMT5WDR77METTL3PIP4K2AADORA3
SCHEMBL25047777 0.84 PRMT5 (0.52) PRMT5WDR77METTL3
SCHEMBL31618081 0.84 PRMT5 (0.52) PRMT5WDR77METTL3
SCHEMBL23135901 0.84 PIP4K2A (0.36) PRMT5WDR77METTL3PIP4K2A
SCHEMBL23137084 0.82 PIP4K2A (0.34) PRMT5WDR77METTL3PIP4K2A
SCHEMBL25047759 0.81 PRMT5 (0.40) PRMT5WDR77METTL3PIP4K2AADORA3
SCHEMBL25046631 0.80 PRMT5 (0.40) PRMT5WDR77METTL3PIP4K2AADORA3
SCHEMBL25048329 0.78 PRMT5 (0.40) PRMT5WDR77METTL3PIP4K2A
SCHEMBL25048728 0.77 PRMT5 (0.39) PRMT5WDR77METTL3PIP4K2AADORA2A
SCHEMBL25047472 0.77 MEN1 (0.35) PRMT5WDR77METTL3PIP4K2A

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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