SCHEMBL3833716

SCHEMBL3833716

COc1cc(O)c(CC(=O)O)cc1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.57
ALDH1A1 P00352 3/20 0.57
TSHR P16473 1/20 0.57
NFKB1 P19838 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
HSD17B10 Q99714 2/20 0.53
HMGCR P04035 3/20 0.50
KDM4E B2RXH2 4/20 0.49
MAPT P10636 4/20 0.49
RECQL P46063 3/20 0.49
POLB P06746 3/20 0.49
ABL1 P00519 1/20 0.49
RIN1 Q13671 1/20 0.49
CTDSP1 Q9GZU7 1/20 0.49
CYP3A4 P08684 2/20 0.46
LMNA P02545 1/20 0.46
HPGD P15428 1/20 0.46
HTT P42858 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
AKR1B1 P15121 1/20 0.42

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
SCHEMBL28603326 0.91 HMGCR (0.61) GAAALDH1A1TSHRNFKB1TDP1
SCHEMBL15760015 0.89 HSD17B10 (0.57) GAAALDH1A1TSHRNFKB1TDP1
SCHEMBL12904365 0.86 GAA (0.54) GAAALDH1A1TSHRNFKB1TDP1
SCHEMBL1096991 0.84 GAA (0.53) GAAALDH1A1TSHRNFKB1TDP1
SCHEMBL4023259 0.84 GAA (0.53) GAAALDH1A1TSHRNFKB1TDP1
SCHEMBL9126180 0.84 HMGCR (0.50) GAAALDH1A1TSHRNFKB1TDP1
SCHEMBL8824094 0.84 HMGCR (0.44) GAAALDH1A1TSHRNFKB1TDP1
SCHEMBL7105968 0.82 POLB (0.44) GAAALDH1A1TSHRNFKB1TDP1
SCHEMBL28355178 0.82 HMGCR (0.60) GAAALDH1A1TSHRNFKB1TDP1
SCHEMBL502877 0.82 AKR1B1 (0.58) GAAALDH1A1TSHRNFKB1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5449518-A Bleaching, decoloring skin L'OREAL (FR) 1995-09-12 US claimed
EP-0526302-B1 Depigmentation composition containing derivatives of (2,5-dihydroxyphenyl)-carboxylica OREAL (FR) 1995-03-01 EP claimed
US-8505730-B2 Compositions, kits and regimens for the treatment of skin, especially décolletage JR CHEM, LLC (US) 2013-08-13 US disclosed
US-20120312717-A1 COMPOSITIONS, KITS AND REGIMENS FOR THE TREATMENT OF SKIN, ESPECIALLY DECOLLETAGE JR CHEM, LLC (US) 2012-12-13 US disclosed
US-8273791-B2 Compositions, kits and regimens for the treatment of skin, especially décolletage JR CHEM, LLC (US) 2012-09-25 US disclosed
EP-2087880-A2 Compositions, kits and regimens for the treatment of skin, especially décolletage Jr Chem, LLC (US) 2009-08-12 EP disclosed
US-20090176876-A1 COMPOSITIONS, KITS AND REGIMENS FOR THE TREATMENT OF SKIN, ESPECIALLY DECOLLETAGE JR CHEM, LLC (US) 2009-07-09 US disclosed
US-6960347-B2 Composition based on N-cholesteryloxycarbonyl-4-para-aminophenol and hydroquinone or one of its derivatives L'OREAL (FR) 2005-11-01 US disclosed
US-20010036446-A1 Composition based on N-cholesteryloxycarbonyl-4-para-aminophenol and hydroquinone or one of its derivatives L'OREAL (FR) 2001-11-01 US disclosed
US-5667792-A CARBOXY DERIVATIVES OF HYDROQUINONE AS BLEACHES FOR SKIN L'OREAL (FR) 1997-09-16 US disclosed
US-5637756-A TREATMENT OF SKIN DISORDERS, BLEACHING OF PIGMENTED SPOTS, COSMETICS L'OREAL (FR) 1997-06-10 US disclosed
US-5587173-A Utilization of derivatives of 2,5 dihydroxyphenyl-carboxylic acid amides and their salts in preparation of a cosmetic or dermatological composition with a depigmenting action L'OREAL (FR) 1996-12-24 US disclosed
US-5585105-A Utilization of derivatives of 2,5-dihydroxyphenylcarboxylic acids, their homologs, and their salts in preparation of a cosmetic or dermatological composition with a depigmenting action L'OREAL (FR) 1996-12-17 US disclosed
US-5449518-A Bleaching, decoloring skin L'OREAL (FR) 1995-09-12 US 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 (1 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-20090176876-A1 COMPOSITIONS, KITS AND REGIMENS FOR THE TREATMENT OF SKIN, ESPECIALLY DECOLLETAGE RARG, RARA, RXRG GAA 2042/4885ALDH1A1 368/4885TSHR 2502/4885

“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.