SCHEMBL5674381

SCHEMBL5674381

CN(C)c1ccc(S(=O)(=O)NC2(OC=O)CCCCC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 2/20 0.42
ALDH1A1 P00352 6/20 0.40
TDP1 Q9NUW8 3/20 0.40
MAPT P10636 2/20 0.40
GFER P55789 2/20 0.40
LMNA P02545 2/20 0.40
MAPK1 P28482 1/20 0.40
MCL1 Q07820 1/20 0.40
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
FLT1 P17948 2/20 0.36
FLT4 P35916 2/20 0.36
KDR P35968 2/20 0.36
F2 P00734 1/20 0.36
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
RAB9A P51151 2/20 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
SCHEMBL5674853 0.82 ALDH1A1 (0.47) ALDH1A1MAPTLMNAMAPK1PKM
SCHEMBL5675309 0.81 GAA (0.42) ALDH1A1LMNAMAPK1KEAP1NPSR1
SCHEMBL5674732 0.78 CA2 (0.45) CA9ALDH1A1MAPTLMNAMAPK1
SCHEMBL5674506 0.78 CA1 (0.50) CA9ALDH1A1GFERLMNAL3MBTL1
SCHEMBL5674376 0.74 USP2 (0.56) CA9ALDH1A1TDP1MAPTGFER
SCHEMBL5674785 0.73 CTSS (0.55) F2PRSS1PRSS2PRSS3EDNRA
SCHEMBL6755512 0.73 ADAM17 (0.49) MMP1MMP13
SCHEMBL5674193 0.72 SLC40A1 (0.40) ALDH1A1MAPTLMNAKEAP1NFE2L2
SCHEMBL14676116 0.69 MAPT (0.44) TDP1MAPTEDNRAPOLBCA2
SCHEMBL7847262 0.67 CA9 (0.36) CA9ALDH1A1TDP1MAPTGFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1616859-B1 Substituted cyclohexyl carboxylic acid compounds SEIKAGAKU KOGYO CO LTD (JP) 2013-09-04 EP claimed
EP-1616859-A1 Substituted cyclohexyl carboxylic acid compounds SEIKAGAKU CORPORATION (JP) 2006-01-18 EP claimed
EP-1616859-B1 Substituted cyclohexyl carboxylic acid compounds SEIKAGAKU KOGYO CO LTD (JP) 2013-09-04 EP disclosed
EP-1619189-B1 N-(3-acyl-2-hydroxyalkyl) cycloalkyl amide derivatives SEIKAGAKU KOGYO CO LTD (JP) 2013-09-04 EP disclosed
EP-1008592-B1 Cyclic amide derivatives which inhibit cathepsin K SEIKAGAKU KOGYO CO LTD (JP) 2006-02-01 EP disclosed
EP-1619189-A1 N-(3-acyl-2-hydroxyalkyl) cycloalkyl amide derivatives SEIKAGAKU CORPORATION (JP) 2006-01-25 EP disclosed
EP-1616867-A1 Hydroxycarboxylic acid derivatives SEIKAGAKU CORPORATION (JP) 2006-01-18 EP disclosed
EP-1616859-A1 Substituted cyclohexyl carboxylic acid compounds SEIKAGAKU CORPORATION (JP) 2006-01-18 EP disclosed
US-6117870-A USEFUL AS THERAPEUTIC DRUG OR PREVENTIVE DRUG OF ARTHRITIS AND RHEUMATISM DUE TO INCREASE OF BONE RESORPTION IN ADDITION TO BONE DISEASES SUCH AS OSTEOPOROSIS, HYPERCALCEMIA, AND PAGET'S DISEASE FUJIREBIO KABUSHIKI KAISHA (JP) 2000-09-12 US disclosed
EP-1008592-A2 Cyclic amide derivatives which inhibit cathepsin K Fujirebio Kabushiki Kaisha (JP) 2000-06-14 EP disclosed