SCHEMBL31123720

SCHEMBL31123720

OC[C@H]1C[C@@H](n2ccc3c(Cl)ncnc32)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NNMT P40261 14/20 0.40
▸ PRMT5 O14744 3/20 0.38
▸ WDR77 Q9BQA1 1/20 0.37
▸ ACACB O00763 1/20 0.36
▸ METTL3 Q86U44 1/20 0.36
▸ SLC29A1 Q99808 1/20 0.36

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
SCHEMBL31123807 0.85 NNMT (0.36) NNMTPRMT5WDR77ACACB
SCHEMBL31123723 0.82 NNMT (0.34) NNMTPRMT5WDR77ACACBSLC29A1
SCHEMBL21682082 0.82 NNMT (0.34) NNMTPRMT5WDR77ACACBSLC29A1
SCHEMBL10248595 0.81 NNMT (0.41) NNMTPRMT5WDR77
SCHEMBL31123774 0.79 PRMT5 (0.33) NNMTPRMT5WDR77ACACBSLC29A1
SCHEMBL31123757 0.79 PRMT5 (0.33) NNMTPRMT5WDR77ACACBSLC29A1
SCHEMBL18925736 0.78 ACACB (0.41) NNMTPRMT5WDR77ACACBSLC29A1
SCHEMBL9469927 0.77 NNMT (0.42) NNMTPRMT5WDR77
SCHEMBL9109736 0.76 AHCY (0.52) NNMTPRMT5WDR77
SCHEMBL22002025 0.76 AHCY (0.52) NNMTPRMT5WDR77

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
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