SCHEMBL31123792

SCHEMBL31123792

C[C@]1(CC(=O)O)[C@H](COc2ccc3cc(Br)c(N)nc3c2)O[C@@H](n2ccc3c(Cl)ncnc32)[C@@H]1CC(=O)O

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 19/20 0.62
WDR77 Q9BQA1 14/20 0.62
METTL3 Q86U44 1/20 0.42

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
SCHEMBL23535889 0.84 PRMT5 (0.87) PRMT5WDR77
SCHEMBL31123387 0.84 PRMT5 (0.87) PRMT5WDR77
SCHEMBL30004313 0.81 PRMT5 (0.62) PRMT5WDR77METTL3
SCHEMBL18572003 0.79 PRMT5 (0.62) PRMT5WDR77METTL3
SCHEMBL31123771 0.78 PRMT5 (0.42) PRMT5WDR77
SCHEMBL31123788 0.77 PRMT5 (0.42) PRMT5WDR77
SCHEMBL29391262 0.77 PRMT5 (1.00) PRMT5WDR77
SCHEMBL20721380 0.77 PRMT5 (1.00) PRMT5WDR77
SCHEMBL20721466 0.76 PRMT5 (1.00) PRMT5WDR77
SCHEMBL29389064 0.76 PRMT5 (1.00) 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
CN-112805006-B PRMT5 inhibitors 默沙东有限责任公司 2024-09-24 CN disclosed