SCHEMBL18572165

SCHEMBL18572165

CC1(C)OC2[C@@H](O1)[C@H](n1ccc3c(Cl)ncnc31)O[C@@H]2CCc1ccc2cc(Cl)c(N)nc2c1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 16/20 0.49
▸ WDR77 Q9BQA1 6/20 0.49
▸ METTL3 Q86U44 3/20 0.49
▸ PI4KA P42356 1/20 0.40
▸ PI4K2B Q8TCG2 1/20 0.40
▸ PI4K2A Q9BTU6 1/20 0.40
▸ PI4KB Q9UBF8 1/20 0.40

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
SCHEMBL18571757 1.00 PRMT5 (0.49) PRMT5WDR77METTL3PI4KAPI4K2B
SCHEMBL18572045 0.94 METTL3 (0.55) PRMT5WDR77METTL3
SCHEMBL18572878 0.92 METTL3 (0.48) PRMT5WDR77METTL3
SCHEMBL18571590 0.91 PRMT5 (0.53) PRMT5WDR77METTL3
SCHEMBL25955020 0.91 PRMT5 (0.53) PRMT5WDR77METTL3
SCHEMBL18571774 0.91 PRMT5 (0.50) PRMT5WDR77METTL3
SCHEMBL18571507 0.91 METTL3 (0.50) PRMT5WDR77METTL3
SCHEMBL18572324 0.88 METTL3 (0.44) PRMT5WDR77METTL3
SCHEMBL22002083 0.87 METTL3 (0.53) PRMT5WDR77METTL3
SCHEMBL18572882 0.87 METTL3 (0.42) PRMT5WDR77METTL3PI4KAPI4K2B

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-2017032840-A1 NOVEL 6-6 BICYCLIC AROMATIC RING SUBSTITUTED NUCLEOSIDE ANALOGUES FOR USE AS PRMT5 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2017-03-02 — — WO disclosed
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