SCHEMBL5675372

SCHEMBL5675372

CN1CCN(C(=O)NC2(C(=O)O)CCCCC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.47
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 2/20 0.46
CTSB P07858 2/20 0.43
CTSS P25774 1/20 0.43
CTSK P43235 1/20 0.43
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
CYP1A2 P05177 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 1/20 0.38
CNR2 P34972 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
SCHEMBL5674323 0.87 EPHX2 (0.47) EPHX2ALDH1A1CTSBCTSSCTSK
SCHEMBL1840796 0.86 CTSB (0.47) ALDH1A1CTSBCTSSCTSKKMT2A
SCHEMBL1840770 0.86 CTSB (0.47) ALDH1A1CTSBCTSSCTSKKMT2A
SCHEMBL5674238 0.84 CYP1A2 (0.48) EPHX2ALDH1A1CTSBCTSSCTSK
SCHEMBL5674494 0.83 CTSK (0.40) EPHX2ALDH1A1CTSBCTSSCTSK
SCHEMBL7533918 0.83 CTSB (0.40) EPHX2KDM4EALDH1A1CTSBCTSS
SCHEMBL5675842 0.81 LMNA (0.52) KDM4EALDH1A1CTSBCTSSCTSK
SCHEMBL5674894 0.80 MAPT (0.51) KDM4EALDH1A1KMT2ATDP1HTT
SCHEMBL5675876 0.80 CTSB (0.43) KDM4EALDH1A1CTSBCTSSCTSK
SCHEMBL5677871 0.80 EPHX2 (0.47) EPHX2ALDH1A1CTSBCTSSCTSK

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 11 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-1619189-B1 N-(3-acyl-2-hydroxyalkyl) cycloalkyl amide derivatives SEIKAGAKU KOGYO CO LTD (JP) 2013-09-04 EP disclosed
EP-1616859-B1 Substituted cyclohexyl carboxylic acid compounds 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
WO-2002023784-A2 CYSTEINE PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2002-03-21 WO 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