SCHEMBL2474875

SCHEMBL2474875

CC1CCC(=O)OC(=O)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
CA1 P00915 2/20 0.44
CA9 Q16790 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.39
CRBN Q96SW2 1/20 0.37
ALDH1A1 P00352 3/20 0.34
CYP2A6 P11509 2/20 0.34
CYP2A13 Q16696 1/20 0.34
HPGD P15428 2/20 0.34
KDM4E B2RXH2 2/20 0.34
LMNA P02545 2/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TLR4 O00206 1/20 0.32
CNR2 P34972 1/20 0.30
HTT P42858 1/20 0.30
CA2 P00918 1/20 0.30

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
SCHEMBL287040 0.82
Ethane SCHEMBL4627940 0.79 SMN1; SMN2 (0.46) TSHRCA1CA9SMN1; SMN2CRBN
SCHEMBL4671527 0.73 CA1 (0.50) TSHRCA1CA9SMN1; SMN2CRBN
SCHEMBL20377422 0.71 TSHR (0.46) TSHRCA1CA9SMN1; SMN2KDM4E
SCHEMBL6400097 0.71 SMN1; SMN2 (0.48) TSHRCA1CA9SMN1; SMN2CRBN
SCHEMBL11128020 0.70 TSHR (0.50) TSHRCA1CA9SMN1; SMN2ALDH1A1
SCHEMBL14049723 0.70 KMT2A (0.52) TSHRCA1CA9SMN1; SMN2ALDH1A1
SCHEMBL1523123 0.69
SCHEMBL418184 0.69
SCHEMBL106510 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1989169-B1 PROCESS FOR MAKING MONOMENTHYL ESTERS RENESSENZ LLC (US) 2017-03-22 EP disclosed
CN-106104895-A Specific lithium battery comprising a non-aqueous electrolyte based on sulfone compounds 雷诺两合公司 2016-11-09 CN disclosed
CN-101910004-B Packaging solutions BAUSCH & LOMB 2012-08-22 CN disclosed
CN-101389588-B Process for making monomenthyl esters MILLENNIUM SPECIALTY CHEM INC 2012-08-08 CN disclosed
EP-2244953-B1 PACKAGING SOLUTIONS BAUSCH & LOMB (US) 2011-10-05 EP disclosed
CN-101910004-A Packaging solutions BAUSCH & LOMB 2010-12-08 CN disclosed
EP-2244953-A2 PACKAGING SOLUTIONS Bausch & Lomb Incorporated (US) 2010-11-03 EP disclosed
CN-101857545-A Synthesis method of single-menthyl KUNMING YUNDA MEDICINE DEV CO LTD 2010-10-13 CN disclosed
WO-2009089206-A2 PACKAGING SOLUTIONS BAUSCH & LOMB INCORPORATED (US) 2009-07-16 WO disclosed
US-20090173045-A1 Packaging Solutions LAI YU-CHIN 2009-07-09 US disclosed
WO-2009079224-A2 SURFACE MODIFIED BIOMEDICAL DEVICES BAUSCH & LOMB INCORPORATED (US) 2009-06-25 WO disclosed
US-20090156745-A1 SURFACE MODIFIED BIOMEDICAL DEVICES LAI YU-CHIN 2009-06-18 US disclosed
CN-101389588-A Process for making monomenthyl esters MILLENNIUM SPECIALTY CHEM INC (US) 2009-03-18 CN disclosed
EP-1989169-A2 PROCESS FOR MAKING MONOMENTHYL ESTERS Millennium Specialty Chemicals, Inc. (US) 2008-11-12 EP disclosed
WO-2007100450-A2 PROCESS FOR MAKING MONOMENTHYL ESTERS MILLENNIUM SPECIALTY CHEMICALS, INC. (US) 2007-09-07 WO disclosed
US-7247743-B1 Process for making monomenthyl esters MILLENNIUM SPECIALTY CHEMICALS, INC. (US) 2007-07-24 US disclosed