SCHEMBL29452047

SCHEMBL29452047

Cc1c(F)cnn(CC(=O)Nc2ccc3c(c2)S(=O)(=O)NCCCN3)c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 8/20 0.47
▸ WDR77 Q9BQA1 8/20 0.47
▸ MAPT P10636 6/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ CRHBP P24387 1/20 0.41
▸ CRHR2 Q13324 1/20 0.41
▸ RAB9A P51151 4/20 0.40
▸ PAX8 Q06710 4/20 0.40
▸ NPC1 O15118 3/20 0.40
▸ L3MBTL1 Q9Y468 3/20 0.40
▸ MITF O75030 2/20 0.40
▸ RIOK1 Q9BRS2 1/20 0.40
▸ USP2 O75604 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.37
▸ TP53 P04637 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ MAPK1 P28482 1/20 0.36

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
SCHEMBL29451784 0.86 PRMT5 (0.44) PRMT5WDR77MAPTRAB9APAX8
SCHEMBL29451404 0.85 RAB9A (0.55) PRMT5WDR77MAPTKMT2AMEN1
SCHEMBL29451540 0.81 FPR1 (0.35) PRMT5WDR77MAPTRAB9ANPC1
SCHEMBL29451308 0.79 RAB9A (0.57) PRMT5WDR77MAPTKMT2AMEN1
SCHEMBL29451486 0.76 PRMT5 (0.47) PRMT5WDR77MAPTKMT2AMEN1
SCHEMBL29452153 0.71 PRMT5 (0.35) PRMT5WDR77MAPTRAB9ANPC1
SCHEMBL29452230 0.69 PRMT5 (0.45) PRMT5WDR77MAPTRAB9APAX8
SCHEMBL29451727 0.69 PRMT5 (0.45) PRMT5WDR77MAPTRAB9APAX8
SCHEMBL29451928 0.65 KDM4E (0.45) PRMT5WDR77MAPTRAB9ANPC1
SCHEMBL29451586 0.60 ABCC8 (0.44) MAPTL3MBTL1KDM4EALDH1A1NPSR1

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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