SCHEMBL490334

SCHEMBL490334

CCOC(=O)C(Cc1cc(OC)cc(OC)c1)C(=O)OCC

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.51
ALDH1A1 P00352 4/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
TSHR P16473 3/20 0.51
TDP1 Q9NUW8 2/20 0.51
LDHA P00338 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
MMP8 P22894 1/20 0.45
CYP3A4 P08684 1/20 0.44
HPGD P15428 1/20 0.44
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.41
TP53 P04637 1/20 0.41
TACR1 P25103 1/20 0.40
NPC1 O15118 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL11558323 0.85 SMN1; SMN2 (0.44) MAPK1ALDH1A1L3MBTL1TSHRTDP1
SCHEMBL2672357 0.84 ALDH1A1 (0.60) MAPK1ALDH1A1L3MBTL1TSHRTDP1
SCHEMBL490486 0.83 LDHA (0.69) MAPK1ALDH1A1L3MBTL1TSHRTDP1
SCHEMBL490500 0.82 LDHA (0.67) ALDH1A1L3MBTL1LDHAPOLBKMT2A
SCHEMBL8568792 0.81 HPGD (0.43) MAPK1ALDH1A1L3MBTL1TSHRTDP1
SCHEMBL6691644 0.80 LDHA (0.50) ALDH1A1LDHAPOLBKMT2ATACR1
SCHEMBL491022 0.80 LDHA (0.47) ALDH1A1LDHAMMP8POLBKMT2A
SCHEMBL490351 0.80 KMT2A (0.51) MAPK1ALDH1A1L3MBTL1LDHASMN1; SMN2
SCHEMBL490610 0.80 ALDH1A1 (0.46) MAPK1ALDH1A1L3MBTL1TSHRTDP1
SCHEMBL20113397 0.79 ALDH1A1 (0.39) MAPK1ALDH1A1L3MBTL1TSHRTDP1

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-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
CN-101163659-B Antioxidants MERCK PATENT GMBH 2012-09-05 CN 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
CN-101163659-A Antioxidants MERCK PATENT GMBH (DE) 2008-04-16 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 MAPK1 1708/4885ALDH1A1 181/4885L3MBTL1 4336/4885
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 MAPK1 3478/4885ALDH1A1 314/4885L3MBTL1 3978/4885

“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.