SCHEMBL25048395

SCHEMBL25048395

Nc1ncnc2c1c(C1CC1)cn2[C@@H]1C[C@H](CNCCCNCCc2cccc(Oc3ccccc3)c2)[C@@H](O)[C@H]1O

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 14/20 0.49
▸ LCK P06239 4/20 0.43
▸ KDR P35968 4/20 0.43
▸ TEK Q02763 4/20 0.43
▸ SRC P12931 3/20 0.43
▸ PRMT5 O14744 2/20 0.40
▸ CA2 P00918 1/20 0.40
▸ PRKD3 O94806 1/20 0.39
▸ PRKCG P05129 1/20 0.39
▸ PRKCB P05771 1/20 0.39
▸ PRKCA P17252 1/20 0.39
▸ PRKCH P24723 1/20 0.39
▸ PRKCI P41743 1/20 0.39
▸ PRKCE Q02156 1/20 0.39
▸ PRKCQ Q04759 1/20 0.39
▸ PRKCZ Q05513 1/20 0.39
▸ PRKCD Q05655 1/20 0.39
▸ PRKD1 Q15139 1/20 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
SCHEMBL30940930 1.00 METTL3 (0.49) METTL3LCKKDRTEKSRC
SCHEMBL25046807 0.91 METTL3 (0.52) METTL3PRMT5CA2
SCHEMBL30940999 0.91 METTL3 (0.52) METTL3PRMT5CA2
SCHEMBL30941227 0.90 METTL3 (0.54) METTL3LCKKDRTEKSRC
SCHEMBL25048398 0.90 METTL3 (0.54) METTL3LCKKDRTEKSRC
SCHEMBL25048399 0.89 LCK (0.51) METTL3LCKKDRTEKSRC
SCHEMBL30940977 0.89 LCK (0.51) METTL3LCKKDRTEKSRC
SCHEMBL25048394 0.89 METTL3 (0.47) METTL3LCKKDRTEKSRC
SCHEMBL30940736 0.89 METTL3 (0.47) METTL3LCKKDRTEKSRC
SCHEMBL25048823 0.88 METTL3 (0.43) METTL3LCKKDRTEKSRC

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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