SCHEMBL29451508

SCHEMBL29451508

CC[C@H](NS(=O)(=O)c1cc(NC(=O)Cn2ncc(Cl)c(Cl)c2=O)ccc1C)C(N)=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.67
▸ PAX8 Q06710 5/20 0.67
▸ L3MBTL1 Q9Y468 4/20 0.67
▸ ALDH1A1 P00352 4/20 0.67
▸ MAPT P10636 4/20 0.67
▸ KMT2A Q03164 3/20 0.67
▸ NPSR1 Q6W5P4 3/20 0.67
▸ POLB P06746 3/20 0.67
▸ RECQL P46063 2/20 0.67
▸ MCL1 Q07820 2/20 0.67
▸ MAPK1 P28482 1/20 0.67
▸ PRMT5 O14744 14/20 0.67
▸ WDR77 Q9BQA1 14/20 0.67
▸ NPC1 O15118 3/20 0.65
▸ MITF O75030 3/20 0.65
▸ RIOK1 Q9BRS2 1/20 0.65
▸ MEN1 O00255 2/20 0.52
▸ S1PR4 O95977 1/20 0.52
▸ S1PR1 P21453 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL29451418 1.00 RAB9A (0.67) RAB9APAX8L3MBTL1ALDH1A1MAPT
SCHEMBL29451336 0.86 PRMT5 (0.64) RAB9APAX8L3MBTL1ALDH1A1MAPT
SCHEMBL29451620 0.86 PRMT5 (0.64) RAB9APAX8L3MBTL1ALDH1A1MAPT
SCHEMBL29451735 0.85 PRMT5 (0.80) RAB9APAX8L3MBTL1ALDH1A1MAPT
SCHEMBL29451400 0.84 RAB9A (0.74) RAB9APAX8L3MBTL1ALDH1A1MAPT
SCHEMBL29451442 0.84 PRMT5 (0.64) RAB9APAX8L3MBTL1ALDH1A1MAPT
SCHEMBL29451477 0.83 RAB9A (0.73) RAB9APAX8L3MBTL1ALDH1A1MAPT
SCHEMBL29451383 0.83 PRMT5 (0.67) RAB9APAX8L3MBTL1ALDH1A1MAPT
SCHEMBL29451656 0.83 PRMT5 (0.67) RAB9APAX8L3MBTL1ALDH1A1MAPT
SCHEMBL29451980 0.82 PRMT5 (0.79) RAB9APAX8L3MBTL1ALDH1A1MAPT

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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