SCHEMBL29451784

SCHEMBL29451784

O=C(Cn1ncc(F)cc1=O)Nc1ccc2c(c1)S(=O)(=O)NCCCN2

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 6/20 0.44
▸ WDR77 Q9BQA1 6/20 0.44
▸ NPC1 O15118 2/20 0.36
▸ MITF O75030 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ PAX8 Q06710 2/20 0.36
▸ MAPT P10636 3/20 0.35
▸ TP53 P04637 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ CHRNB2 P17787 1/20 0.35
▸ CHRNB4 P30926 1/20 0.35
▸ CHRNA3 P32297 1/20 0.35
▸ CHRNA4 P43681 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ RIOK1 Q9BRS2 1/20 0.34
▸ THRB P10828 1/20 0.34

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
SCHEMBL29452047 0.86 PRMT5 (0.47) PRMT5WDR77NPC1MITFRAB9A
SCHEMBL29451404 0.83 RAB9A (0.55) PRMT5WDR77NPC1MITFRAB9A
SCHEMBL29452153 0.81 PRMT5 (0.35) PRMT5WDR77NPC1RAB9AMAPT
SCHEMBL29451308 0.79 RAB9A (0.57) PRMT5WDR77NPC1MITFRAB9A
SCHEMBL29451485 0.72 PRMT5 (0.46) PRMT5WDR77NPC1MITFRAB9A
SCHEMBL29451540 0.71 FPR1 (0.35) PRMT5WDR77NPC1RAB9AMAPT
SCHEMBL29452230 0.67 PRMT5 (0.45) PRMT5WDR77NPC1MITFRAB9A
SCHEMBL29451753 0.66 PRMT5 (0.68) PRMT5WDR77NPC1MITFRAB9A
SCHEMBL29451417 0.63 KMO (0.44) PRMT5WDR77MAPTALDH1A1KDM4E
SCHEMBL29451586 0.62 ABCC8 (0.44) MAPTALDH1A1KDM4EL3MBTL1THRB

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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