SCHEMBL29451645

SCHEMBL29451645

Cc1ccc(NC(=O)[C@H](C)n2ncc(Cl)c(Cl)c2=O)cc1S(=O)(=O)NCCc1ccc(C(=O)O)cc1

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 18/20 0.72
▸ WDR77 Q9BQA1 18/20 0.72
▸ RIOK1 Q9BRS2 2/20 0.56
▸ RAB9A P51151 2/20 0.43
▸ PAX8 Q06710 2/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ MITF O75030 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ MCL1 Q07820 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ TP53 P04637 1/20 0.41

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
SCHEMBL29451643 1.00 PRMT5 (0.72) PRMT5WDR77RIOK1RAB9APAX8
SCHEMBL29452203 0.93 PRMT5 (0.80) PRMT5WDR77RIOK1RAB9APAX8
SCHEMBL29451578 0.93 PRMT5 (0.80) PRMT5WDR77RIOK1RAB9APAX8
SCHEMBL29451910 0.92 PRMT5 (0.71) PRMT5WDR77RIOK1RAB9APAX8
SCHEMBL29451694 0.92 PRMT5 (0.71) PRMT5WDR77RIOK1RAB9APAX8
SCHEMBL29451249 0.91 PRMT5 (0.72) PRMT5WDR77RIOK1RAB9APAX8
SCHEMBL29452041 0.91 PRMT5 (0.72) PRMT5WDR77RIOK1RAB9APAX8
SCHEMBL29451847 0.90 PRMT5 (0.68) PRMT5WDR77RIOK1RAB9APAX8
SCHEMBL29451552 0.90 PRMT5 (0.71) PRMT5WDR77RIOK1RAB9APAX8
SCHEMBL29451636 0.90 PRMT5 (0.71) PRMT5WDR77RIOK1RAB9APAX8

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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