SCHEMBL25049339

SCHEMBL25049339

Nc1nc(Cl)nc2c1ccn2[C@@H]1C[C@H](c2ccc(O)cc2)[C@@H](O)[C@H]1O

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 12/20 0.41
▸ WDR77 Q9BQA1 9/20 0.41
▸ AHCY P23526 1/20 0.40
▸ METTL3 Q86U44 3/20 0.40
▸ METTL14 Q9HCE5 1/20 0.40
▸ NT5E P21589 2/20 0.37
▸ ADORA3 P0DMS8 1/20 0.35
▸ ADORA2A P29274 1/20 0.35
▸ ADORA1 P30542 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
SCHEMBL25048467 0.87 PRMT5 (0.39) PRMT5WDR77AHCYMETTL3METTL14
SCHEMBL25048785 0.85 METTL3 (0.43) PRMT5WDR77AHCYMETTL3METTL14
SCHEMBL31618004 0.85 METTL3 (0.43) PRMT5WDR77AHCYMETTL3METTL14
SCHEMBL25049253 0.84 ADORA3 (0.38) PRMT5WDR77ADORA3ADORA2AADORA1
SCHEMBL30941211 0.83 PRMT5 (0.40) PRMT5WDR77AHCYMETTL3METTL14
SCHEMBL25046819 0.83 PRMT5 (0.40) PRMT5WDR77AHCYMETTL3METTL14
SCHEMBL25048343 0.83 PRMT5 (0.36) PRMT5WDR77NT5EADORA3ADORA2A
SCHEMBL25048572 0.83 PRMT5 (0.39) PRMT5WDR77AHCYMETTL3METTL14
SCHEMBL25048836 0.83 PRMT5 (0.39) PRMT5WDR77AHCYMETTL3METTL14
SCHEMBL25048466 0.82 PRMT5 (0.39) PRMT5WDR77AHCYMETTL3METTL14

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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