SCHEMBL30817867

SCHEMBL30817867

COc1ccc(S(=O)(=O)F)cc1OC

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.70
POLB P06746 1/20 0.70
TSHR P16473 1/20 0.70
LMNA P02545 1/20 0.56
HTT P42858 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
CA12 O43570 1/20 0.53
CA9 Q16790 1/20 0.53
GPBAR1 Q8TDU6 1/20 0.53
FFAR4 Q5NUL3 1/20 0.51
KMT2A Q03164 2/20 0.50
PDE4A P27815 1/20 0.50
PDE4B Q07343 1/20 0.50
PDE4C Q08493 1/20 0.50
PDE4D Q08499 1/20 0.50
MEN1 O00255 1/20 0.50
ALOX15 P16050 1/20 0.50
KEAP1 Q14145 1/20 0.50
NFE2L2 Q16236 1/20 0.50
PTGS2 P35354 1/20 0.49

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
SCHEMBL29164334 1.00 MAPK1 (0.70) MAPK1POLBTSHRLMNAHTT
SCHEMBL29015043 0.84 PTGS2 (0.54) MAPK1POLBTSHRLMNAHTT
SCHEMBL4242536 0.82 CA1 (0.63) MAPK1POLBTSHRLMNAHTT
SCHEMBL862980 0.81 POLB (0.73) MAPK1POLBTSHRLMNAHTT
SCHEMBL7204252 0.80 MAPT (0.72) MAPK1POLBTSHRLMNAHTT
SCHEMBL10800863 0.80 SMN1; SMN2 (0.54) MAPK1POLBTSHRLMNAHTT
SCHEMBL31433349 0.80 ALDH1A1 (0.48) MAPK1POLBTSHRLMNAHTT
SCHEMBL2007287 0.79 POLB (0.70) MAPK1POLBTSHRLMNAHTT
SCHEMBL6038065 0.79 POLB (0.70) MAPK1POLBTSHRLMNAHTT
SCHEMBL66188 0.79 TSHR (0.70) MAPK1POLBTSHRLMNAHTT

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-117658750-A Synthesis process of sulfonyl fluoride compound 南京师范大学 2024-03-08 CN disclosed