SCHEMBL25435602

SCHEMBL25435602

O=S(=O)(NC(c1ccc(C(F)(F)F)cc1)C(F)(F)F)c1ccn2c(Cl)cnc2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
SCN1A P35498 1/20 0.34
SCN5A Q14524 1/20 0.34
SCN8A Q9UQD0 1/20 0.34
EEF2K O00418 3/20 0.33
S1PR1 P21453 2/20 0.33
MCL1 Q07820 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
DYRK1A Q13627 1/20 0.32
DYRK2 Q92630 1/20 0.32
ALOX5AP P20292 2/20 0.32
FEN1 P39748 2/20 0.32
PIK3CA P42336 1/20 0.32
PDE2A O00408 2/20 0.32

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
SCHEMBL25435598 1.00 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2MEN1KMT2ATDP1
SCHEMBL31529481 0.91 PIK3CA (0.40) SCN1ASCN5ASCN8AALOX5APFEN1
SCHEMBL25437180 0.91 PIK3CA (0.40) SCN1ASCN5ASCN8AALOX5APFEN1
SCHEMBL31529527 0.86 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2MEN1KMT2ATDP1
SCHEMBL25706240 0.83 CA1 (0.41) ALDH1A1SMN1; SMN2MEN1KMT2ATDP1
SCHEMBL31529538 0.79 TEAD1 (0.34) ALDH1A1EEF2KS1PR1PDE2AL3MBTL1
SCHEMBL25436309 0.78 MAPT (0.37) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL25436312 0.78 MAPT (0.37) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL30438540 0.78 SCN1A (0.35) ALDH1A1SMN1; SMN2SCN1ASCN5ASCN8A
SCHEMBL25703348 0.78 SCN1A (0.35) ALDH1A1SMN1; SMN2SCN1ASCN5ASCN8A

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-2023094830-A1 SULFONAMIDE COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL CONDITIONS LARIO THERAPEUTICS LIMITED (GB) 2023-06-01 WO disclosed