SCHEMBL30752833

SCHEMBL30752833

CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)C1(COc2cc(Br)cc3c(CN4C(=O)c5ccccc5C4=O)n[nH]c(=O)c23)CC1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 3/20 0.46
▸ WDR77 Q9BQA1 3/20 0.46
▸ PARP1 P09874 10/20 0.35
▸ TNKS O95271 3/20 0.35
▸ TNKS2 Q9H2K2 3/20 0.35
▸ CCNB2 O95067 1/20 0.34
▸ CDK1 P06493 1/20 0.34
▸ CCNB1 P14635 1/20 0.34
▸ GSK3B P49841 1/20 0.34
▸ CCNB3 Q8WWL7 1/20 0.34
▸ KMT2A Q03164 2/20 0.31
▸ MEN1 O00255 1/20 0.30

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
SCHEMBL30752950 0.84 POLB (0.34) PRMT5WDR77PARP1TNKSTNKS2
SCHEMBL31496856 0.80 PRMT5 (0.55) PRMT5WDR77PARP1KMT2AMEN1
SCHEMBL29915065 0.78 PRMT5 (0.61) PRMT5WDR77PARP1KMT2A
SCHEMBL27002364 0.78 PRMT5 (0.61) PRMT5WDR77PARP1KMT2A
SCHEMBL23087658 0.76 PRMT5 (0.64) PRMT5WDR77PARP1KMT2AMEN1
SCHEMBL29735166 0.76 PRMT5 (0.64) PRMT5WDR77PARP1KMT2AMEN1
SCHEMBL30752949 0.72 PRMT5 (0.53) PRMT5WDR77PARP1KMT2A
SCHEMBL31496822 0.72 PRMT5 (0.53) PRMT5WDR77PARP1KMT2A
SCHEMBL31496831 0.72 PRMT5 (0.60) PRMT5WDR77PARP1
SCHEMBL23087513 0.71 PRMT5 (0.67) PRMT5WDR77PARP1

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-2024027703-A1 PRMT5 INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF 上海艾力斯医药科技股份有限公司 2024-02-08 — — WO disclosed
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