SCHEMBL25048771

SCHEMBL25048771

CCc1cn(C2CCC(CNCCCNCCc3ccc(F)cc3)C2)c2ncnc(N)c12

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ RIPK2 O43353 3/20 0.41
▸ IGF1R P08069 3/20 0.40
▸ ABL1 P00519 2/20 0.40
▸ EGFR P00533 2/20 0.40
▸ ABL2 P42684 2/20 0.40
▸ ADCY5 O95622 5/20 0.38
▸ METTL3 Q86U44 2/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ RET P07949 2/20 0.37
▸ PDPK1 O15530 1/20 0.36

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
SCHEMBL25047462 0.91 METTL3 (0.41) RIPK2IGF1RABL1EGFRABL2
SCHEMBL25048776 0.90 EGFR (0.40) RIPK2IGF1RABL1EGFRABL2
SCHEMBL25048766 0.85 METTL3 (0.50) METTL3
SCHEMBL31618069 0.85 METTL3 (0.50) METTL3
SCHEMBL25048517 0.84 ABL1 (0.40) RIPK2IGF1RABL1EGFRABL2
SCHEMBL25047518 0.79 ABL1 (0.44) RIPK2IGF1RABL1EGFRABL2
SCHEMBL25047916 0.78 IGF1R (0.41) RIPK2IGF1RABL1EGFRABL2
SCHEMBL25048005 0.78 ABL1 (0.43) RIPK2IGF1RABL1EGFRABL2
SCHEMBL25047460 0.77 METTL3 (0.48) METTL3
SCHEMBL31618109 0.77 METTL3 (0.48) METTL3

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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