SCHEMBL29451443

SCHEMBL29451443

COC(=O)CNS(=O)(=O)c1cc(NC(=O)Cn2ncc(Cl)c(Cl)c2=O)ccc1C

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 15/20 0.71
▸ WDR77 Q9BQA1 15/20 0.71
▸ RAB9A P51151 5/20 0.68
▸ PAX8 Q06710 5/20 0.68
▸ L3MBTL1 Q9Y468 4/20 0.68
▸ ALDH1A1 P00352 3/20 0.68
▸ MAPT P10636 3/20 0.68
▸ KMT2A Q03164 3/20 0.68
▸ NPC1 O15118 3/20 0.68
▸ MITF O75030 3/20 0.68
▸ POLB P06746 2/20 0.68
▸ RECQL P46063 2/20 0.68
▸ MCL1 Q07820 2/20 0.68
▸ NPSR1 Q6W5P4 2/20 0.68
▸ MAPK1 P28482 1/20 0.68
▸ RIOK1 Q9BRS2 1/20 0.68
▸ MEN1 O00255 2/20 0.58
▸ LMNA P02545 1/20 0.58
▸ HTT P42858 1/20 0.58
▸ S1PR4 O95977 1/20 0.55

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
SCHEMBL29451715 0.89 PRMT5 (0.74) PRMT5WDR77RAB9APAX8L3MBTL1
SCHEMBL29452084 0.86 PRMT5 (0.71) PRMT5WDR77RAB9APAX8L3MBTL1
SCHEMBL29451478 0.85 PRMT5 (0.70) PRMT5WDR77RAB9APAX8L3MBTL1
SCHEMBL29452389 0.85 PRMT5 (0.74) PRMT5WDR77RAB9APAX8L3MBTL1
SCHEMBL29451735 0.85 PRMT5 (0.80) PRMT5WDR77RAB9APAX8L3MBTL1
SCHEMBL29451439 0.84 PRMT5 (0.71) PRMT5WDR77RAB9APAX8L3MBTL1
SCHEMBL29452117 0.84 PRMT5 (0.84) PRMT5WDR77RAB9APAX8L3MBTL1
SCHEMBL29451886 0.84 PRMT5 (0.75) PRMT5WDR77RAB9APAX8L3MBTL1
SCHEMBL29452120 0.84 PRMT5 (0.73) PRMT5WDR77RAB9APAX8L3MBTL1
SCHEMBL29451631 0.83 PRMT5 (0.86) PRMT5WDR77RAB9APAX8L3MBTL1

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-2022032144-A1 SUBSTRATE ADAPTOR INHIBITORS OF PRMT5 AND USES THEREOF THE BROAD INSTITUTE, INC. (US) 2022-02-10 — — WO disclosed
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