SCHEMBL23120385

SCHEMBL23120385

CNc1ncnc2c1ccn2[C@@H]1C[C@H](CNCCCNC(=O)OCc2ccc(Oc3ccc(Cl)cc3)c(F)c2)[C@H]2OC(C)(C)O[C@H]21

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 8/20 0.33
▸ WDR77 Q9BQA1 8/20 0.33
▸ DOT1L Q8TEK3 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
SCHEMBL23120235 0.94 PRMT5 (0.34) PRMT5WDR77
SCHEMBL23120381 0.87 PRMT5 (0.33) PRMT5WDR77
SCHEMBL23120233 0.86 PRMT5 (0.34) PRMT5WDR77
SCHEMBL23137096 0.84 PRMT5 (0.31) PRMT5WDR77
SCHEMBL23137078 0.84 PRMT5 (0.33) PRMT5WDR77
SCHEMBL23120396 0.82 PRMT5 (0.41) PRMT5WDR77
SCHEMBL31617999 0.80 PRMT5 (0.40) PRMT5WDR77
SCHEMBL25046632 0.80 PRMT5 (0.46) PRMT5WDR77
SCHEMBL25046612 0.78 PRMT5 (0.40) PRMT5WDR77
SCHEMBL25049354 0.78 PRMT5 (0.36) 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-2021053158-A1 NOVEL HISTONE METHYLTRANSFERASE INHIBITORS ALBERT-LUDWIGS-UNIVERSITÄT FREIBURG (DE) 2021-03-25 — — WO disclosed
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