SCHEMBL7795903

SCHEMBL7795903

CC(C)(C)c1ccc(O)c(CC(=O)O)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 3/20 0.59
ALDH1A1 P00352 2/20 0.53
HPGD P15428 1/20 0.53
ALOX15 P16050 1/20 0.53
HSD17B10 Q99714 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
AKR1B1 P15121 1/20 0.52
NR1H4 Q96RI1 3/20 0.50
ESR1 P03372 3/20 0.50
ESR2 Q92731 3/20 0.50
RXRA P19793 2/20 0.50
RXRB P28702 2/20 0.50
KLF10 Q13118 1/20 0.50
CYP1A2 P05177 1/20 0.49
CYP2C19 P33261 1/20 0.49
HSP90AA1 P07900 1/20 0.49
HSP90AB1 P08238 1/20 0.49
MEN1 O00255 1/20 0.48
GAA P10253 1/20 0.48
MAPT P10636 1/20 0.48

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
SCHEMBL14076377 0.89 RXRA (0.54) CYP2D6ALDH1A1HPGDALOX15HSD17B10
SCHEMBL7796587 0.86 NR1H4 (0.57) CYP2D6ALDH1A1HPGDALOX15HSD17B10
SCHEMBL21002165 0.84 CYP2D6 (0.67) CYP2D6ALDH1A1HPGDALOX15HSD17B10
SCHEMBL5724612 0.84 CYP2D6 (0.57) CYP2D6ALDH1A1HPGDALOX15HSD17B10
SCHEMBL11599008 0.84 RXRA (0.56) CYP2D6NR1H4RXRARXRBCYP2C19
SCHEMBL1229448 0.82 ESR1 (0.71) CYP2D6ALDH1A1HPGDALOX15HSD17B10
SCHEMBL3567193 0.82 TDP1 (0.51) TDP1NR1H4RXRARXRBCYP2C19
SCHEMBL8580573 0.81 RXRA (0.71) NR1H4RXRARXRBCYP2C19RXRG
SCHEMBL28194254 0.81 CYP2D6 (0.54) CYP2D6ALDH1A1HPGDALOX15HSD17B10
SCHEMBL51058 0.80 CYP2D6 (0.67) CYP2D6ALDH1A1HPGDALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107254085-B Polyolefin auxiliary agent composition with high oxidation resistance 北京吉海川科技发展有限公司 2020-09-25 CN claimed
CN-107254085-B Polyolefin auxiliary agent composition with high oxidation resistance 北京吉海川科技发展有限公司 2020-09-25 CN disclosed
EP-0823435-B1 Phosphites, process for producing the same and their use SUMITOMO CHEMICAL CO (JP) 2001-11-21 EP disclosed
US-6242514-B1 CYCLIC PHOSPHATE OR PHOSPHONATE; HEAT AND OXIDATION STABILIZER ESPECIALLY FOR OLEFIN POLYMERS AND ENGINEERING THERMOPLASTICS SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2001-06-05 US disclosed
US-5914361-A IMPART HEAT STABILITY TO ORGANIC MATERIALS, INCLUDING POLYOLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-22 US disclosed
US-5889095-A OXYGEN AND HEAT RESISTANCE SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1999-03-30 US disclosed
EP-0823435-A2 Phosphites, process for producing the same and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-02-11 EP disclosed