SCHEMBL5676166

SCHEMBL5676166

COC(=O)N1CCC(C(=O)NC2(C(=O)O)CCCCC2)CC1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.42
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 4/20 0.39
EPHX1 P07099 1/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
USP2 O75604 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
MAPT P10636 2/20 0.37
TSHR P16473 2/20 0.37
POLB P06746 1/20 0.37
CYP2C19 P33261 1/20 0.36
HTT P42858 1/20 0.36
ABL1 P00519 1/20 0.36
RIN1 Q13671 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL1840539 0.88 CHRM1 (0.56) CHRM1HPGDSMN1; SMN2MAPTTSHR
SCHEMBL5142124 0.88 HPGD (0.56) HPGDEPHX1NPC1RAB9AABL1
SCHEMBL1840745 0.87 CHRM1 (0.39) CHRM1HPGDSMN1; SMN2NPC1RAB9A
SCHEMBL1840744 0.85 CHRM1 (0.47) CHRM1HPGDSMN1; SMN2NPC1RAB9A
SCHEMBL5678750 0.84 CHRM1 (0.44) CHRM1HPGDSMN1; SMN2NPC1RAB9A
SCHEMBL15241797 0.82 FPR2 (0.38) MAPTTSHR
SCHEMBL16312544 0.81 MAPT (0.38) EPHX1USP2CYP1A2CYP2C9MAPT
SCHEMBL5102682 0.80 HDAC8 (0.39) HPGDEPHX1CYP1A2MAPTPOLB
SCHEMBL5674238 0.80 CYP1A2 (0.48) USP2CYP1A2CYP2C9TSHRCYP2C19
SCHEMBL1842789 0.79 CHRM1 (0.55) CHRM1HPGDSMN1; SMN2MAPTTSHR

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 12 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-1730125-A2 SUBSTITUTED HYDROXYETHYLAMINE ASPARTYL PROTEASE INHIBITORS ELAN PHARMACEUTICALS, INC. (US) 2006-12-13 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-2005087751-A2 SUBSTITUTED HYDROXYETHYLAMINE ASPARTYL PROTEASE INHIBITORS ELAN PHARMACEUTICALS, INC. (US) 2005-09-22 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