SCHEMBL8526845

SCHEMBL8526845

CC(C)(C)C(O)C(O)(C(O)C(C)(C)C)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32

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
SCHEMBL4436411 0.79 TSHR (0.35) TSHR
SCHEMBL2164167 0.73 TSHR (0.41) TSHR
SCHEMBL284631 0.73 ALDH1A1 (0.33) TSHR
SCHEMBL7812010 0.67 TSHR (0.37) TSHR
SCHEMBL12196183 0.65 ALDH1A1 (0.44)
SCHEMBL30120149 0.65 TSHR (0.35) TSHR
SCHEMBL6913725 0.65 TSHR (0.35) TSHR
Fluoride SCHEMBL1975533 0.62 ALDH1A1 (0.41)
SCHEMBL440846 0.62 TSHR (0.33) TSHR
SCHEMBL1530160 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5603760-A WITH OXYALKYLENE GLYCOLS, OXYALKYLENE ADDUCTS OF MONOALCOHOLS AND POLYOLS, AND AMMONIUM SALT(S) OF TALL OIL FATTY ACID, CONSTRUCTION MATERIAL WHICH MAINTAINS AIR ENTRAINMENT W. R. GRACE & CO.-CONN. (US) 1997-02-18 US claimed
JP-7082576-A None JP disclosed
EP-0641854-B1 Diesel fuel ARCO CHEM TECH (US) 1998-12-30 EP disclosed
EP-0758309-A4 CEMENT COMPOSITION ARCO CHEM TECH (US) 1997-07-09 EP disclosed
EP-0758309-A1 CEMENT COMPOSITION ARCO Chemical Technology, L.P. (US) 1997-02-19 EP disclosed
WO-1995030630-A1 CEMENT COMPOSITION ARCO CHEMICAL TECHNOLOGY, L.P. (US) 1995-11-16 WO disclosed
JP-H0782576-A DIESEL FUEL ARCO CHEM TECHNOL LP 1995-03-28 JP disclosed
EP-0641854-A1 Diesel fuel ARCO Chemical Technology, L.P. (US) 1995-03-08 EP disclosed
US-5308365-A Hydrocarbons with emission reducing glycerol ether ARCO CHEMICAL TECHNOLOGY, L.P. (US) 1994-05-03 US disclosed