SCHEMBL19957728

SCHEMBL19957728

COc1ccc(OC(C=O)CNCC(O)CN2CCc3ccccc3C2)cc1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 19/20 0.62
WDR77 Q9BQA1 14/20 0.62
CARM1 Q86X55 1/20 0.56

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
SCHEMBL19957740 0.89 PRMT5 (0.65) PRMT5WDR77CARM1
SCHEMBL19957734 0.85 PRMT5 (0.67) PRMT5WDR77CARM1
SCHEMBL19957562 0.83 PRMT5 (0.67) PRMT5WDR77CARM1
SCHEMBL19957936 0.82 PRMT5 (0.65) PRMT5WDR77
SCHEMBL19957638 0.81 PRMT5 (0.71) PRMT5WDR77
SCHEMBL19957589 0.81 PRMT5 (0.71) PRMT5WDR77
SCHEMBL19957752 0.81 PRMT5 (0.67) PRMT5WDR77CARM1
SCHEMBL19957735 0.80 PRMT5 (0.65) PRMT5WDR77CARM1
SCHEMBL19957828 0.80 PRMT5 (0.66) PRMT5WDR77
SCHEMBL19957519 0.80 PRMT5 (0.64) PRMT5WDR77CARM1

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
EP-2935243-B1 PRMT5 INHIBITORS CONTAINING A DIHYDRO- OR TETRAHYDROISOQUINOLINE AND USES THEREOF EPIZYME INC (US) 2018-03-14 EP disclosed