SCHEMBL25048827

SCHEMBL25048827

Cn1cc(Cl)c(-c2cn(C3CCC(c4cccc(CO)c4)C3)c3nc(Cl)nc(N)c23)n1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 1/20 0.33
▸ DRD3 P35462 1/20 0.33
▸ ABL1 P00519 5/20 0.33
▸ EGFR P00533 4/20 0.33
▸ ABL2 P42684 4/20 0.33
▸ SRC P12931 5/20 0.33
▸ LCK P06239 4/20 0.33
▸ RET P07949 3/20 0.33
▸ KDR P35968 3/20 0.33
▸ FGFR1 P11362 2/20 0.33
▸ FGFR4 P22455 2/20 0.33
▸ PDGFRB P09619 2/20 0.33
▸ PDGFRA P16234 2/20 0.33
▸ FLT1 P17948 2/20 0.33
▸ FLT3 P36888 2/20 0.33
▸ NTRK3 Q16288 2/20 0.33
▸ NTRK2 Q16620 2/20 0.33
▸ JAK2 O60674 1/20 0.33
▸ NTRK1 P04629 1/20 0.33
▸ INSR P06213 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
SCHEMBL25047706 0.89 IGF1R (0.33) DRD2DRD3ABL1EGFRSRC
SCHEMBL25048420 0.89 METTL3 (0.38) RET
SCHEMBL25048826 0.80 METTL3 (0.31) —
SCHEMBL30941484 0.80 METTL3 (0.31) —
SCHEMBL25047714 0.78 METTL3 (0.39) ABL1EGFRSRCLCKRET
SCHEMBL25047863 0.75 METTL3 (0.34) CHKARIPK2
SCHEMBL25047764 0.75 ABL1 (0.40) ABL1EGFRABL2SRCLCK
SCHEMBL25047893 0.74 METTL3 (0.46) ABL1EGFRLCKRETKDR
SCHEMBL25049185 0.72 FGFR1 (0.33) FGFR1FGFR4RIPK2
SCHEMBL25047689 0.72 METTL3 (0.41) DRD2

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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