SCHEMBL19957550

SCHEMBL19957550

CC1CN(c2cccc(OCC(=O)NCCCN3CCc4ccccc4C3)c2S(=O)(=O)N(C)C)CCN1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 18/20 0.50
WDR77 Q9BQA1 13/20 0.50
DRD2 P14416 1/20 0.48
HTR2A P28223 1/20 0.48
HTT P42858 1/20 0.42

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
SCHEMBL19957650 0.90 PRMT5 (0.56) PRMT5WDR77DRD2HTR2A
SCHEMBL19957636 0.88 PRMT5 (0.57) PRMT5WDR77DRD2HTR2A
SCHEMBL17300989 0.87 PRMT5 (0.67) PRMT5WDR77
SCHEMBL19957659 0.86 PRMT5 (0.51) PRMT5WDR77DRD2HTR2A
SCHEMBL19957938 0.85 PRMT5 (0.49) PRMT5WDR77DRD2HTR2AHTT
SCHEMBL19287753 0.78 PRMT5 (0.55) PRMT5WDR77
SCHEMBL19957654 0.77 PRMT5 (0.51) PRMT5WDR77DRD2HTR2A
SCHEMBL17300964 0.77 PRMT5 (0.77) PRMT5WDR77
SCHEMBL19957757 0.77 PRMT5 (0.71) PRMT5WDR77
SCHEMBL17300988 0.76 PRMT5 (0.78) 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