SCHEMBL25047549

SCHEMBL25047549

CN1CCC(C2CCC(n3cc(-c4ccn(Sc5ccccc5)n4)c4c(N)nc(Cl)nc43)C2)CC1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 11/20 0.34
▸ PRMT5 O14744 11/20 0.34
▸ WDR77 Q9BQA1 11/20 0.34
▸ SRC P12931 3/20 0.34
▸ ABL1 P00519 2/20 0.34
▸ EGFR P00533 2/20 0.34
▸ PRKD3 O94806 2/20 0.34
▸ LCK P06239 2/20 0.34
▸ KDR P35968 2/20 0.34
▸ TEK Q02763 2/20 0.34
▸ PRKCD Q05655 2/20 0.34
▸ PLK4 O00444 1/20 0.34
▸ DCLK1 O15075 1/20 0.34
▸ PDPK1 O15530 1/20 0.34
▸ MAP4K4 O95819 1/20 0.34
▸ PAK4 O96013 1/20 0.34
▸ CHEK2 O96017 1/20 0.34
▸ ERBB2 P04626 1/20 0.34
▸ NTRK1 P04629 1/20 0.34
▸ INSR P06213 1/20 0.34

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
SCHEMBL25047538 0.89 PRMT5 (0.34) METTL3PRMT5WDR77SRCABL1
SCHEMBL25047537 0.84 WEE1 (0.35) NTRK1KITAXLFLT3NTRK3
SCHEMBL25047967 0.77 PRMT5 (0.43) METTL3PRMT5WDR77
SCHEMBL25046680 0.77 METTL3 (0.33) METTL3PRMT5WDR77
SCHEMBL25047567 0.76 C1S (0.36) SRCABL1EGFRPRKD3LCK
SCHEMBL25047513 0.76 ALOX15 (0.34) PIM1FGFR1
SCHEMBL25048608 0.75 SRC (0.35) METTL3PRMT5WDR77SRCABL1
SCHEMBL25047572 0.73 IGF1R (0.33) SRCABL1EGFRLCKKDR
SCHEMBL25048354 0.72 METTL3 (0.38) METTL3PRMT5WDR77RET
SCHEMBL30940771 0.69 METTL3 (0.43) METTL3PRMT5WDR77

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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