SCHEMBL25048732

SCHEMBL25048732

Cc1cc(Cl)cc([C@H]2C[C@@H](n3cc(-c4nccs4)c4c(N)ncnc43)[C@@H]3OC(C)(C)O[C@@H]32)c1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 1/20 0.42
▸ METTL3 Q86U44 1/20 0.32
▸ RIPK2 O43353 6/20 0.32
▸ PIKFYVE Q9Y2I7 1/20 0.32
▸ PDGFRB P09619 1/20 0.32
▸ KIT P10721 1/20 0.32
▸ SRC P12931 1/20 0.32
▸ FLT3 P36888 1/20 0.32
▸ SIK1 P57059 1/20 0.32
▸ RIPK4 P57078 1/20 0.32
▸ DDR1 Q08345 1/20 0.32
▸ RIPK1 Q13546 1/20 0.32
▸ DSTYK Q6XUX3 1/20 0.32
▸ RIPK3 Q9Y572 1/20 0.32
▸ RET P07949 1/20 0.30
▸ IGF1R P08069 1/20 0.30
▸ FGFR4 P22455 1/20 0.30

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
SCHEMBL25046626 0.85 ADK (0.49) ADKMETTL3
SCHEMBL25048738 0.84 METTL3 (0.46) ADKMETTL3
SCHEMBL25048548 0.79 ADK (0.53) ADKMETTL3RIPK2
SCHEMBL31617975 0.79 ADK (0.53) ADKMETTL3RIPK2
SCHEMBL25046627 0.78 ADK (0.45) ADKRIPK2PIKFYVEPDGFRBKIT
SCHEMBL25047636 0.77 PRMT5 (0.45) —
SCHEMBL25047443 0.77 ADK (0.40) ADKMETTL3
SCHEMBL25048721 0.72 PRMT5 (0.35) —
SCHEMBL25048597 0.70 ADK (0.35) ADKFGFR4
SCHEMBL30941245 0.70 ADK (0.35) ADKFGFR4

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