SCHEMBL24313610

SCHEMBL24313610

CCOc1c(F)cccc1SN

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.39
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
ALDH1A1 P00352 5/20 0.33
KDM4E B2RXH2 2/20 0.33
KIF11 P52732 1/20 0.33
NPC1 O15118 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
LMNA P02545 2/20 0.32
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KDM1A O60341 2/20 0.31
TUBB1 Q9H4B7 1/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
NQO1 P15559 1/20 0.31
TDP1 Q9NUW8 2/20 0.31
HTR2A P28223 1/20 0.31

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
SCHEMBL21859573 0.84 L3MBTL1 (0.40) L3MBTL1TP53CYP3A4ALDH1A1KDM4E
SCHEMBL24314191 0.82 L3MBTL1 (0.39) L3MBTL1TP53CYP3A4ALDH1A1KDM4E
SCHEMBL1547887 0.80 L3MBTL1 (0.48) L3MBTL1TP53CYP3A4ALDH1A1KDM4E
SCHEMBL22366691 0.76 ALDH1A1 (0.48) L3MBTL1TP53CYP3A4ALDH1A1KDM4E
SCHEMBL13696460 0.73 ACHE (0.44) L3MBTL1CYP3A4KDM4ELMNAMAOA
SCHEMBL1405871 0.73 L3MBTL1 (0.56) L3MBTL1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL14217776 0.73 MAOB (0.44) L3MBTL1TP53CYP3A4ALDH1A1KDM4E
SCHEMBL1618282 0.72 L3MBTL1 (0.42) L3MBTL1TP53ALDH1A1KDM4ENPC1
SCHEMBL12129077 0.72 L3MBTL1 (0.47) L3MBTL1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL23251431 0.72 L3MBTL1 (0.43) L3MBTL1ALDH1A1KDM4ELMNAGAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022081807-A1 SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER THE BROAD INSTITUTE, INC. (US) 2022-04-21 WO disclosed
WO-2022081842-A1 SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER THE BROAD INSTITUTE, INC. (US) 2022-04-21 WO disclosed