SCHEMBL28458420

SCHEMBL28458420

Cc1ccc(S(=O)(=O)n2ccc3cc(/C=C/C(=O)Cl)cnc32)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.51
HDAC1 Q13547 11/20 0.47
HDAC3 O15379 10/20 0.47
HDAC2 Q92769 10/20 0.47
HDAC10 Q969S8 10/20 0.47
HDAC8 Q9BY41 10/20 0.47
HDAC6 Q9UBN7 10/20 0.47
HDAC4 P56524 9/20 0.47
HDAC7 Q8WUI4 9/20 0.47
HDAC11 Q96DB2 9/20 0.47
HDAC9 Q9UKV0 9/20 0.47
HDAC5 Q9UQL6 9/20 0.47
ENPP3 O14638 1/20 0.41
ENPP1 P22413 1/20 0.41
PKM P14618 1/20 0.40
BRD4 O60885 1/20 0.39
RAPGEF4 Q8WZA2 1/20 0.39
CYP2C19 P33261 1/20 0.38
HTR6 P50406 1/20 0.36
PPARG P37231 1/20 0.36

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
SCHEMBL29842808 0.90 L3MBTL1 (0.52) L3MBTL1HDAC1HDAC3HDAC2HDAC10
SCHEMBL29842630 0.90 L3MBTL1 (0.52) L3MBTL1HDAC1HDAC3HDAC2HDAC10
SCHEMBL28455069 0.90 L3MBTL1 (0.52) L3MBTL1HDAC1HDAC3HDAC2HDAC10
SCHEMBL17173854 0.87 HDAC1 (0.64) L3MBTL1HDAC1HDAC3HDAC2HDAC10
SCHEMBL4828082 0.84 L3MBTL1 (0.57) L3MBTL1HDAC1HDAC3HDAC2HDAC10
SCHEMBL15091424 0.83 L3MBTL1 (0.59) L3MBTL1HDAC1HDAC3HDAC2HDAC10
SCHEMBL18549296 0.82 HDAC3 (0.56) L3MBTL1HDAC1HDAC3HDAC2HDAC10
SCHEMBL18549297 0.82 HDAC3 (0.56) L3MBTL1HDAC1HDAC3HDAC2HDAC10
SCHEMBL18549194 0.81 PKM (0.52) L3MBTL1HDAC1HDAC3HDAC2HDAC10
SCHEMBL18549196 0.81 PKM (0.52) L3MBTL1HDAC1HDAC3HDAC2HDAC10

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-111662288-B Small molecule compound for inhibiting AKT and STAT3 activity and application thereof 徐州医科大学 2022-06-14 CN disclosed
CN-111662288-A Small molecular compound for inhibiting AKT and STAT3 activities and application thereof 徐州医科大学 2020-09-15 CN disclosed