SCHEMBL25047809

SCHEMBL25047809

CNc1ncnc2c1ccn2[C@@H]1C[C@H](C(=O)NCCCNCc2cccc(Oc3ccccc3)c2)[C@@H](O)[C@H]1O

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 14/20 0.41
▸ WDR77 Q9BQA1 8/20 0.39
▸ ADORA3 P0DMS8 1/20 0.36
▸ FFAR1 O14842 2/20 0.35

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
SCHEMBL31618039 1.00 PRMT5 (0.41) PRMT5WDR77ADORA3FFAR1
SCHEMBL31618056 0.94 PRMT5 (0.43) PRMT5WDR77
SCHEMBL25048701 0.91 PRMT5 (0.40) PRMT5FFAR1
SCHEMBL31618015 0.90 PRMT5 (0.44) PRMT5WDR77
SCHEMBL25048777 0.85 PRMT5 (0.41) PRMT5WDR77
SCHEMBL25048258 0.84 PRMT5 (0.49) PRMT5WDR77
SCHEMBL31618087 0.84 PRMT5 (0.49) PRMT5WDR77
SCHEMBL25049348 0.83 IGF1R (0.37) PRMT5WDR77
SCHEMBL31617999 0.83 PRMT5 (0.40) PRMT5WDR77
SCHEMBL25049352 0.83 PRMT5 (0.42) PRMT5WDR77

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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