SCHEMBL29451986

SCHEMBL29451986

O=[N+]([O-])c1ccc(F)c(S(=O)(=O)NCCc2ccccn2)c1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.52
ALDH1A1 P00352 2/20 0.51
MAPT P10636 2/20 0.46
KDM4E B2RXH2 1/20 0.46
PKM P14618 2/20 0.46
RAB9A P51151 2/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
NPC1 O15118 1/20 0.43
ATM Q13315 1/20 0.42

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
SCHEMBL29451495 0.87 L3MBTL1 (0.64) L3MBTL1ALDH1A1MAPTKDM4EPKM
SCHEMBL4617110 0.87 L3MBTL1 (0.52) L3MBTL1ALDH1A1MAPTKDM4EPKM
SCHEMBL29451450 0.87 POLB (0.55) L3MBTL1ALDH1A1MAPTKDM4EPKM
SCHEMBL29451717 0.84 MAPT (0.53) L3MBTL1ALDH1A1MAPTKDM4EPKM
SCHEMBL29451535 0.84 L3MBTL1 (0.49) L3MBTL1ALDH1A1MAPTKDM4EPKM
SCHEMBL29452201 0.84 L3MBTL1 (0.49) L3MBTL1ALDH1A1MAPTKDM4EPKM
SCHEMBL4618419 0.84 L3MBTL1 (0.49) L3MBTL1ALDH1A1MAPTKDM4EPKM
SCHEMBL29451543 0.81 KDM4E (0.49) MAPTKDM4ERAB9AMEN1KMT2A
SCHEMBL29451291 0.81 MAPT (0.53) L3MBTL1ALDH1A1MAPTKDM4EPKM
SCHEMBL29451278 0.78 MEN1 (0.48) ALDH1A1MAPTKDM4EPKMRAB9A

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