SCHEMBL4012734

SCHEMBL4012734

Cc1ccc(S(=O)(=O)N2CC(O)CCC2CO)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MCOLN3 Q8TDD5 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
POLB P06746 1/20 0.44
ALDH1A1 P00352 4/20 0.43
KMT2A Q03164 3/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ACHE P22303 1/20 0.42
MMP1 P03956 2/20 0.41
ADAM17 P78536 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MMP2 P08253 1/20 0.41
MEN1 O00255 1/20 0.41
MMP13 P45452 1/20 0.41

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
SCHEMBL3943471 1.00 MCOLN3 (0.49) MCOLN3L3MBTL1POLBALDH1A1KMT2A
SCHEMBL9865528 0.87 MCOLN3 (0.50) MCOLN3L3MBTL1POLBALDH1A1KMT2A
SCHEMBL2389473 0.87 MCOLN3 (0.50) MCOLN3L3MBTL1POLBALDH1A1KMT2A
SCHEMBL9211270 0.87 MCOLN3 (0.50) MCOLN3L3MBTL1POLBALDH1A1KMT2A
SCHEMBL9380136 0.87 MCOLN3 (0.50) MCOLN3L3MBTL1POLBALDH1A1KMT2A
SCHEMBL2389980 0.87 MCOLN3 (0.50) MCOLN3L3MBTL1POLBALDH1A1KMT2A
SCHEMBL9684628 0.87 MCOLN3 (0.50) MCOLN3L3MBTL1POLBALDH1A1KMT2A
SCHEMBL9685672 0.87 MCOLN3 (0.50) MCOLN3L3MBTL1POLBALDH1A1KMT2A
SCHEMBL8474798 0.85 POLB (0.50) MCOLN3L3MBTL1POLBALDH1A1KMT2A
SCHEMBL3934944 0.81 ALDH1A1 (0.44) MCOLN3L3MBTL1ALDH1A1KMT2ALMNA

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
WO-2009106599-A2 SUBSTITUTED PIPERIDINES AS THERAPEUTIC COMPOUNDS NOVARTIS AG (CH) 2009-09-03 WO disclosed
EP-2044059-A1 2,5-DISUBSTITUTED PIPERIDINES Speedel Experimenta AG (CH) 2009-04-08 EP disclosed
WO-2007141318-A1 2,5-DISUBSTITUTED PIPERIDINES SPEEDEL EXPERIMENTA AG (CH) 2007-12-13 WO disclosed