SCHEMBL29025664

SCHEMBL29025664

Cc1ccc(S(=O)(=O)N2CC(=O)CCC2C)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.56
MCOLN3 Q8TDD5 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
MMP2 P08253 2/20 0.51
ANPEP P15144 1/20 0.51
NPSR1 Q6W5P4 1/20 0.46
GAA P10253 1/20 0.45
HPGD P15428 1/20 0.45
AKR1C3 P42330 5/20 0.45
PSEN1 P49768 1/20 0.44
PSEN2 P49810 1/20 0.44
APH1B Q8WW43 1/20 0.44
NCSTN Q92542 1/20 0.44
APH1A Q96BI3 1/20 0.44
PSENEN Q9NZ42 1/20 0.44
MAPT P10636 1/20 0.43
RECQL P46063 1/20 0.43
LMNA P02545 1/20 0.43
PKM P14618 1/20 0.42
MEN1 O00255 1/20 0.42

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
SCHEMBL4047383 0.77 L3MBTL1 (0.67) ACHEMCOLN3L3MBTL1MMP2NPSR1
SCHEMBL6346703 0.77 L3MBTL1 (0.67) ACHEMCOLN3L3MBTL1MMP2NPSR1
SCHEMBL5001507 0.77 L3MBTL1 (0.67) ACHEMCOLN3L3MBTL1MMP2NPSR1
SCHEMBL15013070 0.76 PSEN1 (0.68) ACHENPSR1GAAHPGDAKR1C3
SCHEMBL12169284 0.76 PSEN1 (0.68) ACHENPSR1GAAHPGDAKR1C3
SCHEMBL15845921 0.76 MEN1 (0.51) ACHEMCOLN3L3MBTL1MMP2ANPEP
SCHEMBL14538647 0.75 ACHE (0.86) ACHEMMP2AKR1C3PSEN1PSEN2
SCHEMBL12169285 0.75 ACHE (0.86) ACHEMMP2AKR1C3PSEN1PSEN2
SCHEMBL3116741 0.75 PSEN1 (0.75) ACHEAKR1C3PSEN1PSEN2APH1B
SCHEMBL13248930 0.72 ACHE (1.00) ACHEMCOLN3L3MBTL1AKR1C3PSEN1

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-116143688-B Preparation method of 3-piperidone compound 江南大学 2025-03-11 CN disclosed
CN-116143688-A Preparation method of 3-piperidone compound 江南大学 2023-05-23 CN disclosed