SCHEMBL25047840

SCHEMBL25047840

Cc1ncnc2c1ccn2[C@@H]1C[C@H](C(=O)N(C)CCCNCCc2cccc(Oc3ccccc3)c2)[C@@H](O)[C@H]1O

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 15/20 0.40
▸ METTL3 Q86U44 3/20 0.36
▸ FDFT1 P37268 1/20 0.36
▸ CYP2D6 P10635 1/20 0.34
▸ WDR77 Q9BQA1 2/20 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
SCHEMBL25049352 0.92 PRMT5 (0.42) PRMT5METTL3FDFT1CYP2D6WDR77
SCHEMBL25048777 0.88 PRMT5 (0.41) PRMT5METTL3FDFT1WDR77
SCHEMBL25048298 0.86 PRMT5 (0.42) PRMT5METTL3WDR77
SCHEMBL25047841 0.86 MEN1 (0.37) PRMT5FDFT1CYP2D6
SCHEMBL25048701 0.82 PRMT5 (0.40) PRMT5
SCHEMBL31618056 0.80 PRMT5 (0.43) PRMT5METTL3WDR77
SCHEMBL31618015 0.78 PRMT5 (0.44) PRMT5METTL3WDR77
SCHEMBL25046813 0.77 PRMT5 (0.47) PRMT5METTL3WDR77
SCHEMBL25048258 0.76 PRMT5 (0.49) PRMT5METTL3WDR77
SCHEMBL31618087 0.76 PRMT5 (0.49) PRMT5METTL3WDR77

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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