SCHEMBL19957757

SCHEMBL19957757

O=C(COc1ccccc1N1CCNCC1)NCCCN1CCc2ccccc2C1

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 18/20 0.71
WDR77 Q9BQA1 10/20 0.71
GAA P10253 1/20 0.51
HPGD P15428 1/20 0.51

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
SCHEMBL19957605 0.90 PRMT5 (0.72) PRMT5WDR77GAAHPGD
SCHEMBL19957594 0.89 PRMT5 (0.71) PRMT5WDR77GAAHPGD
SCHEMBL19957650 0.87 PRMT5 (0.56) PRMT5WDR77
SCHEMBL19957763 0.83 PRMT5 (0.52) PRMT5WDR77
SCHEMBL17300983 0.83 PRMT5 (1.00) PRMT5WDR77
SCHEMBL17300987 0.83 PRMT5 (1.00) PRMT5WDR77
SCHEMBL15935385 0.83 PRMT5 (1.00) PRMT5WDR77
SCHEMBL19957667 0.80 PRMT5 (0.66) PRMT5WDR77
SCHEMBL19957640 0.79 PRMT5 (0.71) PRMT5WDR77HPGD
SCHEMBL19957651 0.79 PRMT5 (0.74) 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
EP-2935243-B1 PRMT5 INHIBITORS CONTAINING A DIHYDRO- OR TETRAHYDROISOQUINOLINE AND USES THEREOF EPIZYME INC (US) 2018-03-14 EP disclosed