SCHEMBL25048161

SCHEMBL25048161

CS(=O)(=O)n1ccc(-c2cn([C@H]3CC[C@@H](CNCCCNCCc4ccccc4)C3)c3ncnc(N)c23)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 10/20 0.46
▸ PRMT5 O14744 4/20 0.46
▸ WDR77 Q9BQA1 4/20 0.46
▸ IGF1R P08069 3/20 0.44
▸ ABL1 P00519 2/20 0.42
▸ EGFR P00533 2/20 0.42
▸ ABL2 P42684 2/20 0.42
▸ SRC P12931 3/20 0.41
▸ RIPK2 O43353 1/20 0.40
▸ INSR P06213 1/20 0.39
▸ PRKD3 O94806 1/20 0.39
▸ PRKCG P05129 1/20 0.39
▸ PRKCB P05771 1/20 0.39
▸ LCK P06239 1/20 0.39
▸ PRKCA P17252 1/20 0.39
▸ PRKCH P24723 1/20 0.39
▸ KDR P35968 1/20 0.39
▸ PRKCI P41743 1/20 0.39
▸ PRKCE Q02156 1/20 0.39
▸ TEK Q02763 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
SCHEMBL25048162 0.88 METTL3 (0.46) METTL3PRMT5WDR77IGF1RABL1
SCHEMBL30941581 0.86 METTL3 (0.48) METTL3PRMT5WDR77
SCHEMBL25047829 0.86 METTL3 (0.48) METTL3PRMT5WDR77
SCHEMBL25047965 0.81 ABL1 (0.54) IGF1RABL1EGFRABL2SRC
SCHEMBL25047988 0.80 EGFR (0.46) IGF1RABL1EGFRABL2SRC
SCHEMBL25047518 0.80 ABL1 (0.44) METTL3PRMT5IGF1RABL1EGFR
SCHEMBL30941241 0.79 METTL3 (0.46) METTL3PRMT5WDR77
SCHEMBL25048005 0.78 ABL1 (0.43) IGF1RABL1EGFRABL2SRC
SCHEMBL25047931 0.78 ABL1 (0.41) METTL3PRMT5WDR77IGF1RABL1
SCHEMBL25048490 0.77 ABL1 (0.43) METTL3PRMT5WDR77IGF1RABL1

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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