SCHEMBL25047772

SCHEMBL25047772

C=N/C=C\C(=C/C)[C@H]1C[C@@H](n2ccc3c(Cl)ncnc32)C[C@@H]1OC(C)(C)O

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 4/20 0.31
▸ WDR77 Q9BQA1 3/20 0.31
▸ PIP4K2A P48426 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
SCHEMBL25047775 0.79 PIP4K2A (0.35) PRMT5WDR77PIP4K2A
SCHEMBL25047729 0.78 PRMT5 (0.40) PRMT5WDR77
SCHEMBL24067669 0.78 PRMT5 (0.34) PRMT5WDR77PIP4K2A
SCHEMBL25049137 0.77 NNMT (0.36) PRMT5WDR77PIP4K2A
SCHEMBL19344195 0.72 PRMT5 (0.37) PRMT5WDR77
SCHEMBL20049423 0.72 PRMT5 (0.37) PRMT5WDR77
SCHEMBL16769947 0.69 PRMT5 (0.44) PRMT5WDR77PIP4K2A
SCHEMBL22002062 0.69 ALDH1A1 (0.34) —
SCHEMBL25048850 0.69 NNMT (0.36) —
SCHEMBL21129817 0.69 PRMT5 (0.33) PRMT5WDR77

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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