SCHEMBL25048836

SCHEMBL25048836

Cn1cc([C@H]2C[C@@H](n3ccc4c(N)nc(Cl)nc43)[C@H](O)[C@@H]2O)cn1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 12/20 0.39
▸ WDR77 Q9BQA1 8/20 0.39
▸ MAP4K1 Q92918 4/20 0.36
▸ METTL3 Q86U44 1/20 0.36
▸ METTL14 Q9HCE5 1/20 0.36
▸ AHCY P23526 1/20 0.36
▸ NT5E P21589 1/20 0.35

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
SCHEMBL25047592 0.84 NT5E (0.41) PRMT5WDR77METTL3AHCYNT5E
Hydrochloric Acid SCHEMBL30941286 0.84 NT5E (0.41) PRMT5WDR77METTL3AHCYNT5E
SCHEMBL25049339 0.83 PRMT5 (0.41) PRMT5WDR77METTL3METTL14AHCY
SCHEMBL25047671 0.82 MAP4K1 (0.34) MAP4K1
SCHEMBL31617888 0.82 MAP4K1 (0.34) MAP4K1
SCHEMBL25048467 0.82 PRMT5 (0.39) PRMT5WDR77METTL3METTL14AHCY
SCHEMBL25048572 0.82 PRMT5 (0.39) PRMT5WDR77METTL3METTL14AHCY
SCHEMBL25048466 0.81 PRMT5 (0.39) PRMT5WDR77METTL3METTL14AHCY
SCHEMBL30941587 0.81 PRMT5 (0.39) PRMT5WDR77METTL3METTL14AHCY
SCHEMBL25049042 0.81 PRMT5 (0.39) PRMT5WDR77METTL3METTL14AHCY

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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