SCHEMBL25048343

SCHEMBL25048343

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

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 9/20 0.36
▸ WDR77 Q9BQA1 6/20 0.36
▸ NT5E P21589 2/20 0.34
▸ ADORA3 P0DMS8 4/20 0.34
▸ ADORA2A P29274 3/20 0.34
▸ ADORA1 P30542 3/20 0.34
▸ PNP P00491 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ PDE4D Q08499 1/20 0.33
▸ PDE3A Q14432 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.33

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
SCHEMBL25049339 0.83 PRMT5 (0.41) PRMT5WDR77NT5EADORA3ADORA2A
SCHEMBL25048345 0.82 CHKA (0.35) NT5EADORA3ADORA2AADORA1
SCHEMBL25048290 0.77 PLG (0.37) PRMT5WDR77NT5E
SCHEMBL31618004 0.71 METTL3 (0.43) PRMT5WDR77NT5E
SCHEMBL25048467 0.71 PRMT5 (0.39) PRMT5WDR77NT5E
SCHEMBL25048785 0.71 METTL3 (0.43) PRMT5WDR77NT5E
SCHEMBL25046819 0.70 PRMT5 (0.40) PRMT5WDR77NT5E
SCHEMBL30941211 0.70 PRMT5 (0.40) PRMT5WDR77NT5E
SCHEMBL25048572 0.69 PRMT5 (0.39) PRMT5WDR77NT5E
SCHEMBL25048836 0.69 PRMT5 (0.39) PRMT5WDR77NT5E

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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