SCHEMBL6901287

SCHEMBL6901287

CC(C)C1(C)CCCC(OCC(=O)O)C1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
POLA1 P09884 3/20 0.35
CDC25A P30304 1/20 0.35
CYP1A2 P05177 1/20 0.34
ITGB3 P05106 4/20 0.33
ITGA2B P08514 4/20 0.33

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
SCHEMBL7283672 0.87
SCHEMBL11407846 0.84
SCHEMBL3046441 0.84
SCHEMBL11897016 0.82
SCHEMBL11692275 0.80 CYP1A2 (0.30) CYP1A2
SCHEMBL4389933 0.79
SCHEMBL18825657 0.78 NAAA (0.37)
SCHEMBL11372186 0.78
SCHEMBL7666136 0.78 MEN1 (0.30)
SCHEMBL248360 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-55038362-A None JP disclosed
JP-55038363-A None JP disclosed
JP-55040614-A None JP disclosed
CN-109661180-A Composition and production and preparation method thereof for sports achievement 西雅图咖米公司 2019-04-19 CN disclosed
CN-109640703-A Composition and production and preparation method thereof for mental alertness 西雅图咖米公司 2019-04-16 CN disclosed
CN-109640705-A Mineral composition and its preparation and application 西雅图咖米公司 2019-04-16 CN disclosed
CN-109640704-A Composition and production and preparation method thereof for postexercise recovery 西雅图咖米公司 2019-04-16 CN disclosed
CN-109561727-A Health control composition and its preparation and application 西雅图咖米公司 2019-04-02 CN disclosed
EP-1268581-B1 STABLE INITIATOR SYSTEM JOHNSON & JOHNSON VISION CARE (US) 2004-11-24 EP disclosed
EP-1268581-A2 STABLE INITIATOR SYSTEM Johnson & Johnson Vision Care, Inc. (US) 2003-01-02 EP disclosed
US-4404215-A ANALGESICS, ANTIPYRETICS, ANTIINFLAMMATORY AGENTS SCIENCE UNION ET CIE (FR) 1983-09-13 US disclosed
US-4315020-A Oxazoline (trifluoroethyl) amine SCIENCE UNION ET CIE (FR) 1982-02-09 US disclosed
US-4315019-A Novel aryltrifluoroethylamines and processes for producing the same SCIENCE UNION ET CIE (FR) 1982-02-09 US disclosed
US-4267345-A 2-//PYRROL-2-YL, THIEN-2-YL, OR FUR-2-YL/-ALPHA-TRIFLUOROALKYL-AMINOOXAZOLINES; HYPOTENSIVE AGENTS SCIENCE UNION ET CIE (FR) 1981-05-12 US disclosed
US-4247597-A Electroscopic carrier particles having a carboxylic acid surface treatment PITNEY BOWES, INC. (US) 1981-01-27 US disclosed
US-4246267-A HYPOTENSIVE AGENTS SCIENCE UNION ET CIE (FR) 1981-01-20 US disclosed
JP-S5540614-A PREPARATION OF OPTICALLY ACTIVE N-MERCAPTOACYL-IMINO ACID YOSHITOMI PHARMACEUT IND LTD 1980-03-22 JP disclosed
JP-S5538362-A OPTICALLY ACITIVE THIOL ESTER DERIVATIVE AND ITS PREPARATION YOSHITOMI PHARMACEUT IND LTD 1980-03-17 JP disclosed
JP-S5538363-A PREPARATION OF OPTICALLY ACTIVE N-MERCAPTOACYL-IMINO ACID YOSHITOMI PHARMACEUT IND LTD 1980-03-17 JP disclosed
US-4027028-A HYPOTENSIVE AGENTS SCIENCE UNION ET CIE (FR) 1977-05-31 US disclosed