SCHEMBL25048467

SCHEMBL25048467

COc1ccc([C@H]2C[C@@H](n3ccc4c(N)nc(Cl)nc43)[C@H](O)[C@@H]2O)cc1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 9/20 0.39
▸ WDR77 Q9BQA1 8/20 0.39
▸ METTL3 Q86U44 5/20 0.39
▸ AHCY P23526 1/20 0.38
▸ METTL14 Q9HCE5 1/20 0.38
▸ NT5E P21589 2/20 0.37
▸ KDM1A O60341 2/20 0.36
▸ MAOA P21397 1/20 0.36
▸ MAOB P27338 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
SCHEMBL25048466 0.91 PRMT5 (0.39) PRMT5WDR77METTL3AHCYMETTL14
SCHEMBL30941587 0.91 PRMT5 (0.39) PRMT5WDR77METTL3AHCYMETTL14
Hydrochloric Acid SCHEMBL30940867 0.90 PRMT5 (0.38) PRMT5WDR77METTL3AHCYMETTL14
SCHEMBL25049345 0.88 CHKA (0.41) PRMT5WDR77METTL3AHCYMETTL14
SCHEMBL25049339 0.87 PRMT5 (0.41) PRMT5WDR77METTL3AHCYMETTL14
SCHEMBL25049347 0.87 PRMT5 (0.38) PRMT5WDR77METTL3METTL14NT5E
SCHEMBL25049042 0.86 PRMT5 (0.39) PRMT5WDR77METTL3AHCYMETTL14
SCHEMBL25047896 0.85 NT5E (0.37) PRMT5WDR77METTL3METTL14NT5E
SCHEMBL30941009 0.85 NT5E (0.37) PRMT5WDR77METTL3METTL14NT5E
SCHEMBL25046822 0.84 METTL3 (0.39) PRMT5WDR77METTL3AHCYMETTL14

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-2023017152-A1 SPECIFIC SMALL MOLECULE INHIBITORS THAT BLOCK KMT9 METHYLTRANSFERASE ACTIVITY AND FUNCTION ALBERT-LUDWIGS-UNIVERSITÄT FREIBURG (DE) 2023-02-16 — — WO disclosed
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