SCHEMBL490664

SCHEMBL490664

COc1ccc(OC)c(CC(C(=O)OCCc2ccccc2)C(=O)OCCc2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 2/20 0.52
MTNR1B P49286 2/20 0.51
MTNR1A P48039 1/20 0.51
HSD17B10 Q99714 1/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
ALOX5 P09917 3/20 0.48
PTGES O14684 1/20 0.48
PPARG P37231 1/20 0.48
TSPO P30536 1/20 0.47
POLB P06746 1/20 0.47
TTR P02766 1/20 0.47
HTR2A P28223 1/20 0.47
F2 P00734 1/20 0.46
ELANE P08246 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
SCHEMBL490548 0.90 MEN1 (0.48) CAPN1MTNR1BMTNR1AMEN1KMT2A
SCHEMBL491279 0.86 ALOX5 (0.51) MEN1KMT2AALOX5TTRHTR2A
SCHEMBL490644 0.86 ALOX5 (0.46) MTNR1BMTNR1AMEN1KMT2AALOX5
SCHEMBL491068 0.82 PTPN1 (0.51) MEN1KMT2AALOX5TTR
SCHEMBL490539 0.82 LDHA (0.62) MEN1KMT2AALOX5PPARG
SCHEMBL490819 0.81 ALOX5 (0.64) CAPN1MTNR1BMTNR1AHSD17B10ALOX5
SCHEMBL490447 0.81 POLB (0.47) MEN1KMT2AALOX5POLBTTR
SCHEMBL490927 0.81 LDHA (0.65) KMT2AALOX5TTR
SCHEMBL490381 0.81 ALOX5 (0.48) MEN1KMT2AALOX5PTGESPPARG
SCHEMBL490808 0.80 HSD17B10 (0.55) MTNR1BMTNR1AHSD17B10MEN1KMT2A

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
EP-2238964-A2 Stabilised cosmetic compounds Henkel AG & Co. KGaA (DE) 2010-10-13 EP claimed
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
EP-2238964-A2 Stabilised cosmetic compounds Henkel AG & Co. KGaA (DE) 2010-10-13 EP 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
EP-1871735-A1 ANTIOXIDANTS Merck Patent GmbH (DE) 2008-01-02 EP disclosed
EP-1871339-A1 UV PROTECTION Merck Patent GmbH (DE) 2008-01-02 EP disclosed
WO-2006111233-A1 ANTIOXIDANTS MERCK PATENT GMBH (DE) 2006-10-26 WO disclosed
WO-2006111234-A1 UV PROTECTION MERCK PATENT GMBH (DE) 2006-10-26 WO 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 CAPN1 1743/4885MTNR1B 497/4885MTNR1A 623/4885
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 CAPN1 4061/4885MTNR1B 1635/4885MTNR1A 2347/4885

“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.