SCHEMBL5675644

SCHEMBL5675644

CC(C)COC(=O)N1CCN(C(=O)NC2(C(=O)O)CCCCC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.39
MAPT P10636 3/20 0.39
POLB P06746 2/20 0.38
ABL1 P00519 1/20 0.38
RIN1 Q13671 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
KIT P10721 1/20 0.38
HPGD P15428 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CTSB P07858 1/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
CYP2D6 P10635 1/20 0.35
CYP3A4 P08684 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SLC18A2 Q05940 1/20 0.34
ALDH1A1 P00352 3/20 0.34

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
SCHEMBL5674894 0.87 MAPT (0.51) MAPTPOLBABL1RIN1TDP1
SCHEMBL5678750 0.83 CHRM1 (0.44) RAB9AMAPTTDP1HPGDMEN1
SCHEMBL5674238 0.82 CYP1A2 (0.48) CYP1A2CYP2C9MEN1KMT2ACTSB
SCHEMBL5674903 0.81 CTSL (0.43) RAB9AMAPTPOLBCYP1A2CYP2C9
SCHEMBL17685528 0.80 MEN1 (0.38) RAB9AMAPTPOLBCYP1A2CYP2C9
SCHEMBL5674494 0.78 CTSK (0.40) POLBCYP1A2CYP2C9CTSBCTSS
SCHEMBL5674430 0.78 SLC18A2 (0.42) RAB9AMAPTCTSBCTSSSMN1; SMN2
SCHEMBL5674155 0.77 EPHX2 (0.54) MAPTHPGDMEN1KMT2ACTSB
SCHEMBL5674323 0.76 EPHX2 (0.47) POLBTDP1CYP1A2MEN1KMT2A
SCHEMBL5675372 0.76 EPHX2 (0.47) MAPTTDP1CYP1A2KMT2ACTSB

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 8 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 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