SCHEMBL490426

SCHEMBL490426

COc1cc(OC)c(OC)cc1CCC(=O)OCCc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.68
TDP1 Q9NUW8 1/20 0.58
APP P05067 1/20 0.54
TTR P02766 3/20 0.51
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
AKR1B10 O60218 1/20 0.46
AKR1B1 P15121 1/20 0.46
AKR1C3 P42330 1/20 0.46
LMNA P02545 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAPT P10636 1/20 0.46

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
SCHEMBL490819 0.86 ALOX5 (0.64) ALOX5TDP1APPTTRMAPT
SCHEMBL491128 0.86 ALOX5 (0.64) ALOX5TDP1APPMAPT
SCHEMBL490871 0.84 ALOX5 (0.76) ALOX5TDP1APPTTRKMT2A
SCHEMBL490312 0.82 ALOX5 (0.62) ALOX5TDP1APP
SCHEMBL490578 0.82 ALOX5 (0.62) ALOX5TDP1APPTTRMAPT
SCHEMBL490974 0.81 ALOX5 (0.61) ALOX5TDP1APPTTRKMT2A
SCHEMBL491168 0.81 ALOX5 (0.81) ALOX5TDP1APPKMT2AMAPT
SCHEMBL491005 0.81 ALOX5 (1.00) ALOX5TDP1APPTTRAKR1B10
SCHEMBL491279 0.80 ALOX5 (0.51) ALOX5TTRKMT2AMEN1AKR1B10
SCHEMBL490896 0.80 ALOX5 (0.67) ALOX5TDP1APPTTRAKR1B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8268293-B2 Using compounds which do not themselves exhibit significant UV absorption in the UV-A or UV-B region, but are reactive under use conditions, such as 4-hydroxyphenylpropionic acid, or 2-ethylhexyl 4-hydroxy-3,5-dimethoxycinnamate, or polysiloxanes which contain benzylidenemalonic acid derivatives MERCK PATENT GMBH (DE) 2012-09-18 US disclosed
US-8106233-B2 Applying di-2-ethylhexyl 4-hydroxy-3,5-dimethoxy-benzylmalonate; protective action against UV rays, oxidative stress on body cells, counters skin ageing MERCK PATENT GMBH (DE) 2012-01-31 US disclosed
US-20080171004-A1 Using compounds which do not themselves exhibit significant UV absorption in the UV-A or UV-B region, but are reactive under use conditions, such as 4-hydroxyphenylpropionic acid, or 2-ethylhexyl 4-hydroxy-3,5-dimethoxycinnamate, or polysiloxanes which contain benzylidenemalonic acid derivatives MERCK PATENT GMBH (DE) 2008-07-17 US disclosed
US-20080152603-A1 Antioxidants SUSONITY Commercial GmbH (DE) 2008-06-26 US disclosed
CN-101203278-A Ultraviolet protection MERCK PATENT GMBH (DE) 2008-06-18 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080152603-A1 Antioxidants GPX4, GPX1, CAT ALOX5 180/4885TDP1 1049/4885APP 1760/4885
US-20080171004-A1 Using compounds which do not themselves exhibit significant UV absorption in the UV-A or UV-B region, but are reactive under use conditions, such as 4-hydroxyphenylpropionic acid, or 2-ethylhexyl 4-hydroxy-3,5-dimethoxycinnamate, or polysiloxanes which contain benzylidenemalonic acid derivatives HPD, HAAO, UGT1A6 ALOX5 905/4885TDP1 2793/4885APP 1846/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.