SCHEMBL24313633

SCHEMBL24313633

O=C(NS(=O)(=O)c1ccccc1)c1cc2c(F)cc(C3CC3)cc2o1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.44
BCAT1 P54687 3/20 0.41
PTGER4 P35408 5/20 0.39
FLT1 P17948 1/20 0.39
FLT4 P35916 1/20 0.39
KDR P35968 1/20 0.39
PTGS1 P23219 2/20 0.38
PTGS2 P35354 2/20 0.38
F11 P03951 1/20 0.38
KDM1A O60341 1/20 0.38
KDM4E B2RXH2 1/20 0.37
EGFR P00533 1/20 0.37
ERBB2 P04626 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36
CA12 O43570 1/20 0.36
CA9 Q16790 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
SCHEMBL24313796 0.86 RBP4 (0.42) HPGDBCAT1PTGER4PTGS1PTGS2
SCHEMBL24313726 0.86 PTGER4 (0.36) HPGDPTGER4KDM4EMEN1KMT2A
SCHEMBL31723099 0.86 PTGER4 (0.36) HPGDPTGER4KDM4EMEN1KMT2A
SCHEMBL24313751 0.84 PTGER4 (0.40) HPGDBCAT1PTGER4PTGS1PTGS2
SCHEMBL24313906 0.84 PTGER4 (0.45) HPGDBCAT1PTGER4PTGS1PTGS2
SCHEMBL29588657 0.82 KAT6A (0.36)
SCHEMBL24314318 0.81 FLT1 (0.40) BCAT1FLT1FLT4KDR
SCHEMBL24313753 0.81 MEN1 (0.38) L3MBTL1MEN1LMNAKMT2A
SCHEMBL24333729 0.79 HPGD (0.39) HPGDBCAT1PTGER4F11KDM1A
SCHEMBL24313774 0.79 TRIM24 (0.41) KDM4EL3MBTL1MEN1LMNAKMT2A

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