SCHEMBL692694

SCHEMBL692694

CC(C(=O)O)c1cc(C(C)(C)C)c(O)cc1C(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 5/20 0.54
ALDH1A1 P00352 4/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
MAPT P10636 2/20 0.54
KDM4E B2RXH2 1/20 0.54
CYP1A2 P05177 1/20 0.54
ATP2A2 P16615 1/20 0.54
ATP2A3 Q93084 1/20 0.54
TP53 P04637 3/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C19 P33261 1/20 0.45
LMNA P02545 2/20 0.42
CYP3A4 P08684 2/20 0.42
HPGD P15428 1/20 0.42
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
GLRA3 O75311 1/20 0.39
GLRB P48167 1/20 0.39
NR1I2 O75469 1/20 0.37

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
SCHEMBL6659562 0.86 ALOX15 (0.41) ALOX15ALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL11315634 0.83 ALOX15 (0.50) ALOX15ALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL28163600 0.81 ALDH1A1 (0.48) ALOX15ALDH1A1SMN1; SMN2MAPTKDM4E
Hydrochloric Acid SCHEMBL11337214 0.81 ALOX15 (0.49) ALOX15ALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL28487478 0.79 ALOX15 (0.46) ALOX15ALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL6019249 0.79 ALOX15 (0.46) ALOX15ALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL10939458 0.79 ALOX15 (0.65) ALOX15ALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL1277895 0.78 ALOX15 (0.48) ALOX15ALDH1A1SMN1; SMN2MAPTKDM4E
Bicarbonate SCHEMBL11614213 0.78 ALDH1A1 (0.79) ALOX15ALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL740967 0.77 CYP2C9 (0.48) ALOX15ALDH1A1CYP1A2CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102181140-B Carbon fiber silk waste reinforced polycarbonate composite material and preparation method of the carbon fiber silk waste reinforced polycarbonate composite material UNIV BEIJING CHEMICAL 2012-07-04 CN claimed
US-20120052310-A1 Plasticizer-Containing Films Based On Polyvinyl Acetal Having Selective Permeability For UV Radiation KURARAY EUROPE GMBH (DE) 2012-03-01 US claimed
EP-2422614-A1 Films based on polyvinylacetal containing plasticisers with selective permeability for UV radiation Kuraray Europe GmbH (DE) 2012-02-29 EP claimed
US-20140110039-A1 PVB FILM WITH HIGH UV PROTECTION AND LOW YELLOWNESS INDEX FOR LAMINATED SAFETY GLAZINGS KURARAY EUROPE GMBH (DE) 2014-04-24 US disclosed
EP-2722360-A1 PVB film with high UV protection and low yellowness index for laminated safety glass Kuraray Europe GmbH (DE) 2014-04-23 EP disclosed
EP-2722359-A1 PVB film with high UV protection and low yellowness index for laminated safety glass Kuraray Europe GmbH (DE) 2014-04-23 EP disclosed
US-8383241-B2 Plasticizer-containing films based on polyvinyl acetal having selective permeability for UV radiation KURARAY EUROPE GMBH (DE) 2013-02-26 US disclosed
US-20120052310-A1 Plasticizer-Containing Films Based On Polyvinyl Acetal Having Selective Permeability For UV Radiation KURARAY EUROPE GMBH (DE) 2012-03-01 US disclosed
EP-2422614-A1 Films based on polyvinylacetal containing plasticisers with selective permeability for UV radiation Kuraray Europe GmbH (DE) 2012-02-29 EP disclosed
US-4701273-A Lubricant compositions containing antioxidants, amine phosphates and 4- (5-) methyl-1-[di-(2-ethylhexyl) aminomethyl]-benzotriazole CIBA-GEIGY CORPORATION (US) 1987-10-20 US disclosed