SCHEMBL4070526

SCHEMBL4070526

C=CC(=O)OC(C)(OC(=O)C=C)c1ccccc1C(C)(C)N

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 3/20 0.37
THRB P10828 4/20 0.35
ALDH1A1 P00352 3/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2C9 P11712 1/20 0.33
THRA P10827 1/20 0.33
ATM Q13315 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GSR P00390 1/20 0.33
AKT1 P31749 1/20 0.32
MAOB P27338 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
MAPT P10636 3/20 0.31
KMT2A Q03164 2/20 0.31
GSTO1 P78417 1/20 0.30
HPGD P15428 2/20 0.30
HIF1A Q16665 2/20 0.30
BCHE P06276 1/20 0.30
KDM4E B2RXH2 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
Hydrochloric Acid SCHEMBL7049938 0.81 THRB (0.33) CYP2C19THRBALDH1A1CYP3A4CYP2C9
SCHEMBL31132053 0.79 THRB (0.39) CYP2C19THRBALDH1A1CYP3A4CYP2C9
SCHEMBL5483835 0.78 CYP2C19 (0.35) CYP2C19THRBALDH1A1CYP3A4CYP2C9
Hydrochloric Acid SCHEMBL17698428 0.78 THRB (0.46) CYP2C19THRBALDH1A1CYP3A4CYP2C9
SCHEMBL30887689 0.77 CYP2C19 (0.44) CYP2C19THRBALDH1A1CYP3A4CYP2C9
SCHEMBL2743763 0.74 HCAR2 (0.37) CYP2C19THRBALDH1A1CYP3A4CYP2C9
SCHEMBL4663494 0.74 ALOX15 (0.36) CYP2C19ALDH1A1CYP3A4CYP2C9CYP1A2
SCHEMBL4928340 0.73 THRB (0.35) CYP2C19THRBALDH1A1CYP3A4CYP2C9
Hydrochloric Acid SCHEMBL2470314 0.73 HCAR2 (0.36) CYP2C19THRBALDH1A1CYP3A4CYP1A2
SCHEMBL3454099 0.73 THRB (0.49) THRBALDH1A1CYP3A4THRAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3670540-B1 STARCH-CONTAINING MICROSPHERE AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF CHINA PETROLEUM & CHEM CORP (CN) 2023-07-26 EP claimed
EP-1379566-B1 ION-SENSITIVE CATIONIC POLYMERS AND FIBROUS ITEMS USING SAME KIMBERLY CLARK CO (US) 2009-07-29 EP claimed
EP-1475075-B1 Alcaline straightening of the hair in the presence of a hydrosoluble polymer having a high molecular weight OREAL (FR) 2009-07-22 EP claimed
EP-1419897-B1 Ink jet recording material AGFA GEVAERT (BE) 2007-06-27 EP claimed
EP-1561452-A1 Cosmetic composition comprising a cationic polymer and a high molecular weight polymer; use thereof L'OREAL (FR) 2005-08-10 EP claimed
EP-1555011-A1 Cosmetic detergent composition comprising an aminofunctional silicone and a high molecular weight polymer L'OREAL (FR) 2005-07-20 EP claimed
EP-1552811-A1 Detergent cosmetic compositions comprising a tenside, a high molecular weight spinning polymer and a conditioning agent and use thereof L'OREAL (FR) 2005-07-13 EP claimed
EP-1552808-A1 Cosmetic detergent composition comprising a surfactant, a high molecular weight polymer and particles L'OREAL (FR) 2005-07-13 EP claimed
EP-1552810-A1 Cosmetic detergent composition comprising a silicone and a high molecular weight polymer L'OREAL (FR) 2005-07-13 EP claimed
EP-1552809-A1 Cosmetic composition comprising a cationic surfactant, a high molecular weight spinning polymer and a thickener and cosmetic process L'OREAL (FR) 2005-07-13 EP claimed
EP-1475075-A1 Alcaline straighening of the hair in the presence of a hydrosoluble polymer having a high molecular weight L'OREAL (FR) 2004-11-10 EP claimed
EP-1430876-A1 Composition containing a direct dyestuff and a specific polymer for colouring of keratinic fibres, method for the preparation thereof and process of dyeing with such a composition L'OREAL (FR) 2004-06-23 EP claimed
EP-1430877-A1 Composition for dyeing of keratinous fibres containing an oxidation base and a specific polymer, process of preparation of this composition and process of dyeing with this composition L'OREAL (FR) 2004-06-23 EP claimed
WO-2002041856-A1 USE IN COSMETICS OF A WATER SOLUBLE POLYMER IN THE FORM OF A DISPERSION AND COSMETIC COMPOSITION CONTAINING SAME L'OREAL (FR) 2002-05-30 WO claimed
EP-0717056-B1 An aqueous dispersion of an amphoteric water-soluble polymer, a method of manufacturing the same, and a treating agent comprising the same HYMO CORP (JP) 1999-06-23 EP claimed
EP-0855407-A1 Aqueous dispersions based on water soluble polymers ELF ATOCHEM S.A. (FR) 1998-07-29 EP claimed
EP-1475075-B1 Alcaline straightening of the hair in the presence of a hydrosoluble polymer having a high molecular weight OREAL (FR) 2009-07-22 EP disclosed
EP-1561452-A1 Cosmetic composition comprising a cationic polymer and a high molecular weight polymer; use thereof L'OREAL (FR) 2005-08-10 EP disclosed
WO-2002034796-A1 AQUEOUS DISPERSIONS OF A WATER SOLUBLE POLYMER, METHOD FOR PREPARING SAME, AND USES THEREOF SNF S.A. (FR) 2002-05-02 WO disclosed
EP-0855407-A1 Aqueous dispersions based on water soluble polymers ELF ATOCHEM S.A. (FR) 1998-07-29 EP disclosed