SCHEMBL19957513

SCHEMBL19957513

Cc1cn(C)c2cccc(OCC(=O)NCCCN3CCc4ccccc4C3)c12

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 17/20 0.74
WDR77 Q9BQA1 8/20 0.52
DRD2 P14416 1/20 0.47
HTR2A P28223 1/20 0.47

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
SCHEMBL15935442 0.85 PRMT5 (1.00) PRMT5WDR77
SCHEMBL15935455 0.85 PRMT5 (1.00) PRMT5WDR77
SCHEMBL15935454 0.85 PRMT5 (1.00) PRMT5WDR77
SCHEMBL19957605 0.79 PRMT5 (0.72) PRMT5WDR77DRD2HTR2A
SCHEMBL19957637 0.78 PRMT5 (0.71) PRMT5WDR77DRD2HTR2A
SCHEMBL19957667 0.77 PRMT5 (0.66) PRMT5WDR77DRD2HTR2A
SCHEMBL19957616 0.77 PRMT5 (0.51) PRMT5WDR77DRD2HTR2A
SCHEMBL19957640 0.77 PRMT5 (0.71) PRMT5WDR77
SCHEMBL19957718 0.76 PRMT5 (0.73) PRMT5WDR77
SCHEMBL19957594 0.75 PRMT5 (0.71) PRMT5WDR77DRD2HTR2A

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