SCHEMBL28367643

SCHEMBL28367643

CC(C)CC(NS(=O)(=O)Cc1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSK P43235 8/20 0.52
CTSS P25774 2/20 0.49
CTSL P07711 1/20 0.49
CTSB P07858 1/20 0.49
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HTT P42858 1/20 0.49
KMT2A Q03164 1/20 0.49
S1PR4 O95977 1/20 0.47
S1PR1 P21453 1/20 0.47
CA12 O43570 1/20 0.46
CA2 P00918 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46

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
SCHEMBL18775042 1.00 CTSK (0.52) CTSKCTSSCTSLCTSBMEN1
SCHEMBL18775043 0.86 CTSK (0.54) CTSKCTSSCTSLCTSBS1PR4
SCHEMBL25634647 0.86 CTSK (0.54) CTSKCTSSCTSLCTSBS1PR4
SCHEMBL3969628 0.85 ALDH1A1 (0.55) MEN1ALDH1A1HTTKMT2ACA2
SCHEMBL15251810 0.85 ALDH1A1 (0.55) MEN1ALDH1A1HTTKMT2ACA2
SCHEMBL15251696 0.85 ALDH1A1 (0.55) MEN1ALDH1A1HTTKMT2ACA2
SCHEMBL24855401 0.84 CTSK (0.57) CTSKCTSSCTSLCTSB
SCHEMBL18775046 0.84 CTSK (0.57) CTSKCTSSCTSLCTSB
SCHEMBL10058280 0.84 CASP1 (0.50) CA12CA2CA9
SCHEMBL17792880 0.83 ALDH1A1 (0.54) CTSKCTSSCTSLMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116370448-A Modulators of SESTRIN-GATOR2 interactions and uses thereof 纳维托制药有限公司 2023-07-04 CN disclosed
CN-110809467-B Modulators of SESTRIN-GATOR2 interactions and uses thereof 纳维托制药有限公司 2023-03-10 CN disclosed
CN-110809467-A Modulators of SESTRIN-GATOR2 interaction and uses thereof 纳维托制药有限公司 2020-02-18 CN disclosed