SCHEMBL360473

SCHEMBL360473

NC(=O)C(O)(c1ccccc1)C1CCCCC1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.72
NFE2L2 Q16236 1/20 0.72
CHRM3 P20309 11/20 0.58
CHRM2 P08172 9/20 0.58
CHRM1 P11229 8/20 0.58
POLB P06746 1/20 0.52
ALDH1A1 P00352 1/20 0.51
KCNH2 Q12809 2/20 0.50
SLC6A3 Q01959 1/20 0.50
HTT P42858 1/20 0.49
CHRM4 P08173 1/20 0.49
CHRM5 P08912 1/20 0.49
HRH1 P35367 1/20 0.49
HTR2B P41595 1/20 0.49

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
SCHEMBL4618170 1.00 KEAP1 (0.72) KEAP1NFE2L2CHRM3CHRM2CHRM1
SCHEMBL1431227 1.00 KEAP1 (0.72) KEAP1NFE2L2CHRM3CHRM2CHRM1
SCHEMBL4620506 0.98 KEAP1 (0.74) KEAP1NFE2L2CHRM3CHRM2CHRM1
SCHEMBL27515279 0.95 KEAP1 (0.69) KEAP1NFE2L2CHRM3CHRM2CHRM1
Ethylene SCHEMBL27498090 0.92 KEAP1 (0.65) KEAP1NFE2L2CHRM3CHRM2CHRM1
Cadaverine Tartrate SCHEMBL27624850 0.86 KEAP1 (0.58) KEAP1NFE2L2CHRM3CHRM2CHRM1
SCHEMBL29903954 0.86 KEAP1 (0.96) KEAP1NFE2L2CHRM3CHRM2CHRM1
SCHEMBL198082 0.86 KEAP1 (0.96) KEAP1NFE2L2CHRM3CHRM2CHRM1
SCHEMBL1235433 0.86 KEAP1 (0.96) KEAP1NFE2L2CHRM3CHRM2CHRM1
SCHEMBL2764243 0.86 KEAP1 (0.96) KEAP1NFE2L2CHRM3CHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1948164-A1 PHARMACEUTICAL COMPOSITIONS OF MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES, LTD. (IN) 2008-07-30 EP claimed
EP-1888525-A1 3,6-DISUBSTITUTED AZABICYCLO [3.1.0]HEXANE DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2008-02-20 EP claimed
WO-2007045979-A1 PHARMACEUTICAL COMPOSITIONS OF MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2007-04-26 WO claimed
WO-2006117754-A1 3,6-DISUBSTITUTED AZABICYCLO [3.1.0] HEXANE DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2006-11-09 WO claimed
CN-103097340-B Therapeutically active compositions and methods of use thereof 安吉奥斯医药品有限公司 2018-03-16 CN disclosed
CN-102089290-B Triazole derivatives useful for the treatment of diseases PFIZER 2013-09-04 CN disclosed
EP-2593425-A1 THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHOD OF USE Agios Pharmaceuticals, Inc. (US) 2013-05-22 EP disclosed
WO-2012009678-A1 THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHOD OF USE AGIOS PHARMACEUTICALS, INC. (US) 2012-01-19 WO disclosed
CN-102089290-A Triazole derivatives useful for the treatment of diseases PFIZER LTD 2011-06-08 CN disclosed
CN-100519526-C Azabicyclo derivatives as muscarinic receptor antagonists RANBAXY LAB LTD (IN) 2009-07-29 CN disclosed
CN-1794985-A Azabicyclo derivatives as muscarinic receptor antagonists RANBAXY LAB LTD (IN) 2006-06-28 CN disclosed
CN-1681784-A Azabicyclo derivatives as muscarinic receptor antagonists RANBAXY LAB LTD (IN) 2005-10-12 CN disclosed
US-6207852-B1 THERAPY FOR INCONTINENCE; CROHN'S DISEASE; MUSCLE RELAXANTS BRIDGE PHARMA, INC. 2001-03-27 US disclosed
EP-0915826-A4 SMOOTH MUSCLE SPASMOLYTIC AGENTS, COMPOSITIONS AND METHODS OF USE THEREOF BRIDGE PHARMA INC (US) 1999-12-29 EP disclosed
EP-0915826-A1 SMOOTH MUSCLE SPASMOLYTIC AGENTS, COMPOSITIONS AND METHODS OF USE THEREOF Bridge Pharma, Inc. (US) 1999-05-19 EP disclosed
WO-1998000390-A1 SMOOTH MUSCLE SPASMOLYTIC AGENTS, COMPOSITIONS AND METHODS OF USE THEREOF BRIDGE PHARMA, INC. (US) 1998-01-08 WO disclosed
CN-1044938-A Acetamide compound of a kind of new replacement and preparation method thereof FUJISAWA PHARMACEUTICAL CO (JP) 1990-08-29 CN disclosed
EP-0383256-A2 A novel substituted-acetamide compound and a process for the preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-08-22 EP disclosed