SCHEMBL726575

SCHEMBL726575

CC(C)(C)CC(C)(C)OC(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.51
CYP2C19 P33261 2/20 0.51
CYP1A2 P05177 1/20 0.51
TDP1 Q9NUW8 5/20 0.50
TSHR P16473 4/20 0.50
ALDH1A1 P00352 3/20 0.50
HSD17B10 Q99714 1/20 0.50
POLB P06746 1/20 0.50
HIF1A Q16665 2/20 0.47
MAPK1 P28482 1/20 0.47
LMNA P02545 2/20 0.47
F2 P00734 1/20 0.47
MAPT P10636 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
SLC6A3 Q01959 2/20 0.43
KMT2A Q03164 2/20 0.43
HTR1A P08908 1/20 0.43
SCN1A P35498 1/20 0.43
SCN5A Q14524 1/20 0.43
SCN2A Q99250 1/20 0.43

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
SCHEMBL5363372 0.90 MAPK1 (0.44) CYP2D6CYP2C19CYP1A2TDP1TSHR
SCHEMBL263461 0.85 TDP1 (0.58) CYP2D6CYP2C19CYP1A2TDP1TSHR
SCHEMBL9133035 0.83 TSHR (0.47) CYP2C19TDP1TSHRALDH1A1HSD17B10
SCHEMBL444728 0.83 CYP2D6 (0.61) CYP2D6CYP2C19CYP1A2TDP1TSHR
SCHEMBL5085501 0.83 CYP2D6 (0.53) CYP2D6CYP2C19CYP1A2TDP1TSHR
Hydrogen Peroxide SCHEMBL28730771 0.83 CYP2D6 (0.61) CYP2D6CYP2C19CYP1A2TDP1TSHR
SCHEMBL4576579 0.83 CYP2D6 (0.66) CYP2D6CYP2C19CYP1A2TDP1TSHR
SCHEMBL3677745 0.82 TDP1 (0.66) CYP2D6CYP2C19CYP1A2TDP1TSHR
SCHEMBL2804706 0.81 CYP2D6 (0.51) CYP2D6CYP2C19CYP1A2TDP1TSHR
Water SCHEMBL5946543 0.81 CYP2D6 (0.59) CYP2D6CYP2C19CYP1A2TDP1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1572752-B1 POLYMERIZATION PROCESSES EXXONMOBIL CHEM PATENTS INC (US) 2014-08-13 EP claimed
EP-1578806-B1 POLYMERIZATION PROCESSES EXXONMOBIL CHEM PATENTS INC (US) 2013-05-22 EP claimed
EP-1572753-B1 POLYMERIZATION PROCESSES EXXONMOBIL CHEM PATENTS INC (US) 2012-06-13 EP claimed
JP-4729040-B2 2011-07-20 JP claimed
EP-1578822-B1 POLYMERS SUBSTANTIALLY FREE OF LONG CHAIN BRANCHING EXXONMOBIL CHEM PATENTS INC (US) 2011-04-06 EP claimed
EP-1572751-B1 POLYMERIZATION PROCESSES EXXONMOBIL CHEM PATENTS INC (US) 2010-06-23 EP claimed
US-7723447-B2 slurry polymerization in presence a cationic catalyst system, an environmentally friendly hydrofluorocarbon diluent, of one or more monomer(s) to form a single phase polymerization medium; prevent agglomeration and reactor fouling; utilizing boiling pool reactor systems EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-05-25 US claimed
US-7491773-B2 Halogenated polymers with new sequence distributions EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-02-17 US claimed
US-7425601-B2 Polymers with new sequence distributions EXXONMOBIL CHEMICAL PATENTS INC. (US) 2008-09-16 US claimed
US-7423100-B2 Polymerization processes EXXONMOBIL CHEMICAL PATENTS INC. (US) 2008-09-09 US claimed
EP-1572763-A2 POLYMERS WITH NEW SEQUENCE DISTRIBUTIONS ExxonMobil Chemical Patents Inc. (US) 2005-09-14 EP claimed
US-20050107536-A1 Polymers with new sequence distributions EXXONMOBIL CHEMICAL PATENTS INC. 2005-05-19 US claimed
US-20050101751-A1 Halogenated polymers with new sequence distributions EXXONMOBIL CHEMICAL PATENTS INC. 2005-05-12 US claimed
WO-2004067577-A2 POLYMERIZATION PROCESSES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-08-12 WO claimed
WO-2004058829-A1 POLYMERIZATION PROCESSES EXXONMOBIL CHEMICAL PATENTS, INC. (US) 2004-07-15 WO claimed
WO-2004058836-A1 POLYMERS WITH NEW SEQUENCE DISTRIBUTIONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-07-15 WO claimed
WO-2004058828-A1 POLYMERIZATION PROCESSES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-07-15 WO claimed
WO-2004058825-A2 POLYMERS WITH NEW SEQUENCE DISTRIBUTIONS EXXONMOBIL CHEMICAL PATENTS, INC. (US) 2004-07-15 WO claimed
WO-2004058827-A1 POLYMERIZATION PROCESSES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-07-15 WO claimed
WO-2004058835-A1 POLYMERS SUBSTANTIALLY FREE OF LONG CHAIN BRANCHING EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-07-15 WO claimed