SCHEMBL30958764

SCHEMBL30958764

NS(=O)(=O)N1CCCc2ccccc21

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.57
KMT2A Q03164 6/20 0.56
MEN1 O00255 4/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
ATM Q13315 1/20 0.55
LMNA P02545 2/20 0.52
TP53 P04637 1/20 0.52
AKR1C3 P42330 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.51
HCRTR1 O43613 1/20 0.51
ALDH1A1 P00352 1/20 0.51
GAA P10253 1/20 0.51
HTT P42858 1/20 0.51
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50

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
SCHEMBL1134878 1.00 TSHR (0.57) TSHRKMT2AMEN1L3MBTL1ATM
SCHEMBL651847 0.89 KMT2A (0.58) TSHRKMT2AMEN1L3MBTL1LMNA
SCHEMBL29638283 0.89 KMT2A (0.58) TSHRKMT2AMEN1L3MBTL1LMNA
SCHEMBL30866830 0.84 TSHR (0.59) TSHRKMT2AMEN1L3MBTL1ATM
SCHEMBL5261945 0.84 TSHR (0.59) TSHRKMT2AMEN1L3MBTL1ATM
SCHEMBL13311778 0.82 KMT2A (0.60) TSHRKMT2AMEN1L3MBTL1ATM
SCHEMBL692761 0.82 L3MBTL1 (0.60) TSHRKMT2AMEN1L3MBTL1ATM
SCHEMBL29595267 0.82 L3MBTL1 (0.60) TSHRKMT2AMEN1L3MBTL1ATM
SCHEMBL12418312 0.82 KMT2A (0.60) TSHRKMT2AMEN1L3MBTL1ATM
SCHEMBL27359666 0.82 KMT2A (0.60) TSHRKMT2AMEN1L3MBTL1ATM

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118812398-A Bissulfonylimide compound, preparation method and application thereof 中国科学院上海有机化学研究所 2024-10-22 CN disclosed
CN-117903016-A Fluorosulfonyl sulfonimide salt, preparation method and application thereof 中国科学院上海有机化学研究所 2024-04-19 CN disclosed