SCHEMBL7796587

SCHEMBL7796587

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

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 4/20 0.57
CYP2D6 P10635 3/20 0.56
ALDH1A1 P00352 2/20 0.50
HSP90AA1 P07900 1/20 0.50
HSP90AB1 P08238 1/20 0.50
HPGD P15428 1/20 0.50
ALOX15 P16050 1/20 0.50
HSD17B10 Q99714 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
RXRA P19793 1/20 0.50
RXRB P28702 1/20 0.50
RXRG P48443 1/20 0.50
NPSR1 Q6W5P4 2/20 0.49
CHEK1 O14757 1/20 0.49
FYN P06241 1/20 0.49
PDGFRB P09619 1/20 0.49
PIM1 P11309 1/20 0.49
FGFR1 P11362 1/20 0.49
FLT1 P17948 1/20 0.49
GRK5 P34947 1/20 0.49

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
SCHEMBL16517033 0.87 RXRA (0.56) NR1H4CYP2D6HSP90AA1HSP90AB1RXRA
SCHEMBL7795903 0.86 CYP2D6 (0.59) NR1H4CYP2D6ALDH1A1HSP90AA1HSP90AB1
SCHEMBL21002165 0.85 CYP2D6 (0.67) CYP2D6ALDH1A1HSP90AA1HSP90AB1HPGD
SCHEMBL13580640 0.85 NR1H4 (0.59) NR1H4RXRARXRBRXRGNPSR1
SCHEMBL29040644 0.81 NR1H4 (0.52) NR1H4ALDH1A1RXRARXRBRXRG
SCHEMBL13580505 0.81 NR1H4 (0.52) NR1H4RXRARXRBRXRGNPSR1
SCHEMBL11001144 0.81 CYP2D6 (0.47) NR1H4CYP2D6ALDH1A1HSP90AA1HSP90AB1
SCHEMBL28863770 0.80 CYP2D6 (0.61) CYP2D6ALDH1A1HSP90AA1HSP90AB1HPGD
SCHEMBL5165521 0.80 CYP2D6 (0.61) CYP2D6ALDH1A1HSP90AA1HSP90AB1HPGD
SCHEMBL1229448 0.80 ESR1 (0.71) CYP2D6ALDH1A1HSP90AA1HSP90AB1HPGD

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
CN-117916316-A Polyamide composition and article 巴斯夫欧洲公司 2024-04-19 CN disclosed
CN-100549077-C Additive agent mixture CIBA SC HOLDING AG (CH) 2009-10-14 CN disclosed
CN-1863859-A additive mixture CIBA SC HOLDING AG (CH) 2006-11-15 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