SCHEMBL24334281

SCHEMBL24334281

O=S(=O)(NC(O)c1cc2c(F)cc(N3CCC3)cc2o1)c1ccccc1C1=NOCCO1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 11/20 0.32
FEN1 P39748 11/20 0.32
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
GFER P55789 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL29469622 0.84 KMT2A (0.33) ALOX5APFEN1ALDH1A1GAAMAPT
SCHEMBL24334438 0.77 SLC22A12 (0.36) ALDH1A1GAAMAPTGFERKMT2A
SCHEMBL24333964 0.77 HTR6 (0.33) ALDH1A1GAAMAPTGFERKMT2A
SCHEMBL24334248 0.76 ALDH1A1 (0.32) ALDH1A1GAAMAPTGFERKMT2A
SCHEMBL24333670 0.76 CCR8 (0.33) ALDH1A1GAAMAPTGFERKMT2A
SCHEMBL24334285 0.75 NPC1 (0.33) ALDH1A1MAPTKMT2A
SCHEMBL24333377 0.72 LMNA (0.34) ALDH1A1MAPTKMT2A
SCHEMBL24333658 0.72 ALDH1A1 (0.35) ALDH1A1MAPTKMT2A
SCHEMBL24334394 0.72 PGAM1 (0.33) ALDH1A1GAAMAPTKMT2A
SCHEMBL24334224 0.72 NFE2L2 (0.35) ALDH1A1GAAMAPT

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