SCHEMBL25048823

SCHEMBL25048823

C=Cc1cn([C@@H]2C[C@H](CNCCCNCCc3cccc(Oc4ccccc4)c3)[C@@H](O)[C@H]2O)c2ncnc(N)c12

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 12/20 0.43
▸ PRMT5 O14744 4/20 0.41
▸ CA2 P00918 2/20 0.39
▸ LCK P06239 3/20 0.39
▸ KDR P35968 3/20 0.39
▸ TEK Q02763 3/20 0.39
▸ SRC P12931 2/20 0.39

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
SCHEMBL30941360 1.00 METTL3 (0.43) METTL3PRMT5CA2LCKKDR
SCHEMBL25048824 0.91 METTL3 (0.43) METTL3PRMT5CA2
SCHEMBL30941036 0.91 METTL3 (0.43) METTL3PRMT5CA2
SCHEMBL30941227 0.89 METTL3 (0.54) METTL3PRMT5CA2LCKKDR
SCHEMBL25048398 0.89 METTL3 (0.54) METTL3PRMT5CA2LCKKDR
SCHEMBL25048399 0.89 LCK (0.51) METTL3CA2LCKKDRTEK
SCHEMBL30940977 0.89 LCK (0.51) METTL3CA2LCKKDRTEK
SCHEMBL25048394 0.88 METTL3 (0.47) METTL3PRMT5CA2LCKKDR
SCHEMBL25048395 0.88 METTL3 (0.49) METTL3PRMT5CA2LCKKDR
SCHEMBL30940736 0.88 METTL3 (0.47) METTL3PRMT5CA2LCKKDR

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
Send feedback