SCHEMBL30401746

SCHEMBL30401746

CCCCCCCN(F)S(=O)(=O)c1ccc(F)cc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.55
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
LMNA P02545 1/20 0.47
SERPINE1 P05121 1/20 0.46
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
HSD17B10 Q99714 1/20 0.45
MCHR1 Q99705 1/20 0.44
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 1/20 0.42
FFAR1 O14842 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
PTGES O14684 2/20 0.40
ALOX5 P09917 2/20 0.40

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
SCHEMBL29028661 0.87 MCHR1 (0.59) CNR2KMT2AMEN1SERPINE1MCHR1
SCHEMBL29028380 0.86 SERPINE1 (0.44) CNR2SERPINE1MCHR1TDP1ALDH1A1
SCHEMBL29028581 0.85 TDP1 (0.60) CNR2SERPINE1MCHR1TDP1PTGES
SCHEMBL29028430 0.83 CNR2 (0.56) CNR2SERPINE1TSHRHSD17B10ALDH1A1
SCHEMBL29800510 0.79 TSHR (0.42) CNR2KMT2AMEN1LMNATSHR
SCHEMBL20245163 0.77 KMT2A (0.54) CNR2KMT2AMEN1LMNATSHR
SCHEMBL15673081 0.74 CNR2 (0.49) CNR2KMT2ATSHRMAPK1HSD17B10
SCHEMBL15672859 0.74 CNR2 (0.49) CNR2KMT2ATSHRMAPK1HSD17B10
SCHEMBL24162488 0.74 KMT2A (0.74) CNR2KMT2AMEN1LMNATSHR
SCHEMBL27633187 0.74 ALDH1A1 (0.52) CNR2KMT2AMCHR1ALDH1A1FFAR1

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
CN-115974732-A Method for preparing alkyl sulfonyl fluoride 中国石油大学(华东) 2023-04-18 CN disclosed