SCHEMBL6352500

SCHEMBL6352500

CC(C)(C)c1cc(C(C)(C)C)c([O-])c(C(C)(C)C)c1.CC(C)(C)c1cc(C(C)(C)C)c([O-])c(C(C)(C)C)c1.C[Al+2]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
POLB P06746 2/20 0.36
ALDH1A1 P00352 5/20 0.35
ALOX15 P16050 3/20 0.35
CYP1A2 P05177 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
ATP2A2 P16615 1/20 0.35
ATP2A3 Q93084 1/20 0.35
HSP90AA1 P07900 1/20 0.34
CYP2C9 P11712 2/20 0.33
TYR P14679 2/20 0.33
HSD17B10 Q99714 2/20 0.33
NR1I2 O75469 1/20 0.33
LMNA P02545 1/20 0.33
MIF P14174 1/20 0.33
HTT P42858 1/20 0.33
NFE2L2 Q16236 1/20 0.33

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
SCHEMBL7179397 0.92 GABRA1 (0.40) GABRA1GABRB2POLBALDH1A1ALOX15
SCHEMBL7177257 0.92 GABRA1 (0.40) GABRA1GABRB2POLBALDH1A1ALOX15
Lithium Ion SCHEMBL3626995 0.92 GABRA1 (0.40) GABRA1GABRB2POLBALDH1A1ALOX15
Potassium Ion SCHEMBL11494507 0.92 GABRA1 (0.40) GABRA1GABRB2POLBALDH1A1ALOX15
SCHEMBL2638545 0.92 GABRA1 (0.40) GABRA1GABRB2POLBALDH1A1ALOX15
SCHEMBL6356731 0.88 GABRA1 (0.37) GABRA1GABRB2POLBALDH1A1ALOX15
Butylated Hydroxytoluene SCHEMBL496998 0.80 ALDH1A1 (0.52) POLBALDH1A1ALOX15CYP1A2SMN1; SMN2
SCHEMBL8664189 0.78 ALDH1A1 (0.33) POLBALDH1A1ALOX15CYP1A2SMN1; SMN2
SCHEMBL20597506 0.76 CYP2C19 (0.36) GABRA1GABRB2POLBALDH1A1CYP1A2
SCHEMBL5679072 0.75 ALDH1A1 (0.40) ALDH1A1ALOX15CYP1A2SMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0510602-B1 Living polymerization method KANSAI PAINT CO LTD (JP) 1996-06-26 EP claimed
EP-0510602-A1 Living polymerization method KANSAI PAINT CO., LTD. (JP) 1992-10-28 EP claimed
US-6844398-B2 Ethylenic copolymer, composition containing said copolymer, and ethylenic copolymer film IDEMITSU KOSAN CO., LTD. (JP) 2005-01-18 US disclosed
US-20020188087-A1 Ethylenic copolymer, composition containing said copolymer, and ethylenic copolymer film IDEMITSU KOSAN CO., LTD. (JP) 2002-12-12 US disclosed
US-6441116-B1 FILM FORMED FROM AN ETHYLENIC COPOLYMER WHICH HAS A NARROW MOLECULAR WEIGHT DISTRIBUTION AND A NARROW BRANCHING DEGREE DISTRIBUTION AND HAS A CONTROLLED COMPOSITIONAL DISTRIBUTION PROFILE, TEAR STRENGTH, HEAT SEALING IDEMITSU KOSAN CO., LTD. (JP) 2002-08-27 US disclosed
EP-0510602-B1 Living polymerization method KANSAI PAINT CO LTD (JP) 1996-06-26 EP disclosed
US-5328970-A Porphyrin complex as catalyst with organo aluminum compounds for polymerization KANSAI PAINT CO., LTD. (JP) 1994-07-12 US disclosed
EP-0510602-A1 Living polymerization method KANSAI PAINT CO., LTD. (JP) 1992-10-28 EP disclosed