SCHEMBL23120396

SCHEMBL23120396

CNc1ncnc2c1ccn2[C@@H]1C[C@H](CNCCCNC(=O)OCCc2ccc3cc(Cl)c(Cl)cc3c2)[C@H]2OC(C)(C)O[C@H]21

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 18/20 0.41
▸ WDR77 Q9BQA1 9/20 0.41
▸ METTL3 Q86U44 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
SCHEMBL23120235 0.88 PRMT5 (0.34) PRMT5WDR77
SCHEMBL23120394 0.86 PRMT5 (0.40) PRMT5WDR77METTL3
SCHEMBL23137017 0.84 PRMT5 (0.39) PRMT5WDR77METTL3
SCHEMBL23120385 0.82 PRMT5 (0.33) PRMT5WDR77
SCHEMBL23137083 0.78 PRMT5 (0.38) PRMT5WDR77METTL3
SCHEMBL23120185 0.77 EZH2 (0.39) PRMT5WDR77METTL3
SCHEMBL23120181 0.77 EZH2 (0.39) PRMT5WDR77METTL3
SCHEMBL25047750 0.75 PRMT5 (0.42) PRMT5WDR77METTL3
SCHEMBL25047700 0.75 PRMT5 (0.40) PRMT5WDR77METTL3
SCHEMBL18571751 0.73 PRMT5 (0.66) PRMT5WDR77METTL3

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-2021053158-A1 NOVEL HISTONE METHYLTRANSFERASE INHIBITORS ALBERT-LUDWIGS-UNIVERSITÄT FREIBURG (DE) 2021-03-25 — — WO disclosed
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