SCHEMBL2033491

SCHEMBL2033491

COC(=O)C1(Cc2ccc(Cl)cc2)CCC(C)C1=O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
SSTR1 P30872 1/20 0.41
SSTR4 P31391 1/20 0.41
TACR1 P25103 1/20 0.40
TACR3 P29371 1/20 0.40
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 2/20 0.38
OPRM1 P35372 1/20 0.36
OPRL1 P41146 1/20 0.36
SLC6A3 Q01959 3/20 0.36
EPHX1 P07099 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPT P10636 1/20 0.35
TP53 P04637 1/20 0.35
MDM2 Q00987 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
SCHEMBL8830753 0.88 TACR1 (0.41) POLBTACR1TACR3ALDH1A1SMN1; SMN2
SCHEMBL5348003 0.88 POLB (0.55) POLBALDH1A1SMN1; SMN2LMNAOPRM1
SCHEMBL17483916 0.87 TACR1 (0.40) POLBTACR1TACR3SMN1; SMN2LMNA
SCHEMBL17483907 0.87 TACR1 (0.50) TACR1TACR3ALDH1A1SMN1; SMN2MEN1
SCHEMBL8830804 0.86 POLB (0.41) POLBSSTR1SSTR4SMN1; SMN2MEN1
SCHEMBL6052983 0.85 POLB (0.40) POLBSSTR1SSTR4ALDH1A1SMN1; SMN2
SCHEMBL8830783 0.85 TACR1 (0.46) POLBTACR1TACR3ALDH1A1SMN1; SMN2
SCHEMBL8830795 0.85 POLB (0.42) POLBSSTR1SSTR4TACR1TACR3
SCHEMBL8830782 0.85 POLB (0.42) POLBSSTR1SSTR4TACR1TACR3
SCHEMBL8831006 0.85 TACR1 (0.39) TACR1TACR3ALDH1A1SMN1; SMN2LMNA

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 60 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7166750-B1 Process for the preparation of 5-[(4-chlorophenyl)methyl]-2,2-dimethylcyclopentanone KUREHA CORPORATION (JP) 2007-01-23 US claimed
EP-1308432-B1 PROCESS FOR THE PREPARATION OF 5- (4-CHLOROPHENYL)-METHYL|-2,2-DIMETHYLCYCLOPENTANONE KUREHA CORP (JP) 2006-10-18 EP claimed
EP-1308432-A1 PROCESS FOR THE PREPARATION OF 5- (4-CHLOROPHENYL)-METHYL]-2,2-DIMETHYLCYCLOPENTANONE KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2003-05-07 EP claimed
JP-8245517-A None JP disclosed
CN-103596917-B The manufacture method of cyclopentanone compound and midbody compound 株式会社吴羽 2016-08-17 CN disclosed
EP-2719693-B1 METHOD FOR MANUFACTURING OXETANE COMPOUND, METHOD FOR MANUFACTURING AZOLYLMETHYLCYCLOPENTANOL COMPOUND, AND INTERMEDIATE COMPOUND KUREHA CORP (JP) 2016-08-10 EP disclosed
CN-102639509-B Azole derivative, process for producing the same, intermediate of the same, and agricultural or horticultural agent KUREHA CORP. (JP) 2016-03-23 CN disclosed
US-9278966-B2 Method for manufacturing oxetane compound, method for manufacturing azolylmethylcyclopentanol compound, and intermediate compound KUREHA CORPORATION (JP) 2016-03-08 US disclosed
US-9278966-B2 Method for manufacturing oxetane compound, method for manufacturing azolylmethylcyclopentanol compound, and intermediate compound KUREHA CORPORATION (JP) 2016-03-08 US disclosed
US-9278966-B2 Method for manufacturing oxetane compound, method for manufacturing azolylmethylcyclopentanol compound, and intermediate compound KUREHA CORPORATION (JP) 2016-03-08 US disclosed
US-9253983-B2 Triazole compound and use thereof KUREHA CORPORATION (JP) 2016-02-09 US disclosed
JP-H08245517-A PRODUCTION OF ALKYLCYCLOPENTANONE DERIVATIVE KUREHA CHEM IND CO LTD 1996-09-24 JP disclosed
EP-0731083-A1 Process for the producing of alkylcyclopentanone derivatives KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1996-09-11 EP disclosed
US-5414105-A Alkyl esters of benzyl-substituted 2-oxocyclopentanecarboxylic acids; azoles have plant disease controlling and plant growth regulating activity KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1995-05-09 US disclosed
US-5239089-A Plant growth controllers KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1993-08-24 US disclosed
EP-0267778-B1 AZOLE DERIVATIVES USEFUL IN CONTROLLING PLANT DISEASES AND REGULATING PLANT GROWTH KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1993-03-24 EP disclosed
US-5159118-A Chemical intermediate; controlling plant diseases, plant growth regulators, fungicides KUREHA KAGAKU KABUSHIKI KAISHA (JP) 1992-10-27 US disclosed
US-5028254-A Fungicides, plant growth regulators KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1991-07-02 US disclosed
US-4938792-A Fungicide, plant growth regulator KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1990-07-03 US disclosed
EP-0267778-A2 Azole derivatives useful in controlling plant diseases and regulating plant growth KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1988-05-18 EP disclosed