SCHEMBL25049351

SCHEMBL25049351

Nc1nc(Cl)nc2c1c(Br)cn2[C@@H]1C[C@H](CNCCCNCCc2ccc(F)cc2)[C@@H](O)[C@H]1O

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 14/20 0.45
▸ PRMT5 O14744 3/20 0.33
▸ WDR77 Q9BQA1 1/20 0.33
▸ CA2 P00918 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
SCHEMBL25046695 1.00 METTL3 (0.45) METTL3PRMT5WDR77CA2
SCHEMBL30941447 1.00 METTL3 (0.45) METTL3PRMT5WDR77CA2
SCHEMBL25048971 0.88 CA2 (0.38) METTL3PRMT5CA2
SCHEMBL25047810 0.87 METTL3 (0.59) METTL3PRMT5CA2
SCHEMBL31618086 0.87 METTL3 (0.59) METTL3PRMT5CA2
SCHEMBL30941617 0.83 METTL3 (0.38) METTL3PRMT5
SCHEMBL25046824 0.83 METTL3 (0.38) METTL3PRMT5
SCHEMBL25048295 0.82 PRMT5 (0.33) METTL3PRMT5CA2
SCHEMBL25047846 0.79 METTL3 (0.56) METTL3PRMT5
SCHEMBL25046614 0.79 METTL3 (0.59) METTL3PRMT5CA2

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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