SCHEMBL2990397

SCHEMBL2990397

CC(=O)c1c(O)ccc(O)c1C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.58
PRKCI P41743 1/20 0.47
CYP3A4 P08684 3/20 0.46
MEN1 O00255 1/20 0.46
HPGD P15428 1/20 0.46
KMT2A Q03164 1/20 0.46
CA9 Q16790 4/20 0.46
CA12 O43570 3/20 0.39
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA7 P43166 3/20 0.39
CA14 Q9ULX7 3/20 0.39
ALDH1A1 P00352 2/20 0.38
CSNK1A1 P48729 1/20 0.37
CSNK1D P48730 1/20 0.37
CLK2 P49760 1/20 0.37
CSNK1G1 Q9HCP0 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TRPA1 O75762 1/20 0.37
ATM Q13315 1/20 0.37

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
SCHEMBL6451162 0.84 THRB (0.70) THRBPRKCICYP3A4MEN1HPGD
SCHEMBL15214029 0.82 THRB (0.45) THRBPRKCICYP3A4MEN1HPGD
SCHEMBL16334846 0.82 THRB (0.50) THRBPRKCICYP3A4MEN1HPGD
SCHEMBL5224771 0.81 THRB (0.48) THRBPRKCICA9CA12CA1
SCHEMBL1520727 0.80 CA12 (0.54) THRBCYP3A4CA9CA12CA1
SCHEMBL14795733 0.79 CYP3A4 (0.53) THRBCYP3A4MEN1KMT2ACA9
SCHEMBL1878648 0.77 THRB (0.61) THRBPRKCICYP3A4MEN1HPGD
SCHEMBL29973339 0.76 THRB (0.54) THRBPRKCICYP3A4MEN1HPGD
SCHEMBL3280277 0.76 THRB (0.54) THRBPRKCICYP3A4MEN1HPGD
SCHEMBL3957334 0.76 TDP1 (0.47) THRBCYP3A4HPGDCA9ALDH1A1

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180155311-A1 SEPARATION OF CHIRAL ISOMERS BY SFC DSM IP ASSETS B.V. (NL) 2018-06-07 US disclosed
EP-3303314-A1 SEPARATION OF CHIRAL ISOMERS BY SFC DSM IP Assets B.V. (NL) 2018-04-11 EP disclosed
WO-2016188945-A1 SEPARATION OF CHIRAL ISOMERS BY SFC DSM IP ASSETS B.V. (NL) 2016-12-01 WO disclosed
EP-2758366-B1 PROCESS FOR PREPARING CHIRAL QUINONE DSM IP ASSETS BV (NL) 2016-04-27 EP disclosed
US-9045402-B2 Process for preparing chiral quinone DSM IP ASSETS B.V. (NL) 2015-06-02 US disclosed
CN-103562159-B Process of separating chiral isomers of chroman compounds and their derivatives and precursors DSM IP ASSETS BV 2015-04-15 CN disclosed
EP-2758366-A1 PROCESS FOR PREPARING CHIRAL QUINONE DSM IP Assets B.V. (NL) 2014-07-30 EP disclosed
US-20140206905-A1 PROCESS FOR PREPARING CHIRAL QUINONE SAM IP ASSETS B.V. (NL) 2014-07-24 US disclosed
CN-103562159-A Process of separating chiral isomers of chroman compounds and their derivatives and precursors DSM IP ASSETS BV 2014-02-05 CN disclosed
WO-2013041676-A1 PROCESS FOR PREPARING CHIRAL QUINONE DSM IP ASSETS B.V. (NL) 2013-03-28 WO disclosed
US-7777073-B2 Topical delivery system for antiaging and skin whitening agents BIODERM RESEARCH (US) 2010-08-17 US disclosed
US-20090253668-A1 Hair Loss Prevention by Natural Amino Acid and Peptide Complexes BIODERM RESEARCH (US) 2009-10-08 US disclosed
US-7572933-B2 Skin and hair restoration by natural amino acid peptide complexes BIODERM RESEARCH (US) 2009-08-11 US disclosed
US-20090074691-A1 Topical Delivery System for Antiaging and Skin Whitening Agents BIODERM RESEARCH (US) 2009-03-19 US disclosed
US-20080287536-A1 Skin and Hair Restoration by Natural Amino Acid and Peptide Crown Complexes BIODERM RESEARCH (US) 2008-11-20 US disclosed
US-20080255228-A1 Ascorbic Acid Complexes for Skin Care Including Treatment of Dark Skin & Wrinkles BIODERM RESEARCH (US) 2008-10-16 US disclosed
US-20080254130-A1 Skin Antiaging & Brightening via Multi-function Treatment of Enzyme Dysfunction BIODERM RESEARCH (US) 2008-10-16 US disclosed
US-7427690-B2 Multifunction “crown complexes” from amino acids and peptides for skin and hair restoration BIODERM RESEARCH (US) 2008-09-23 US disclosed
US-20070099886-A1 Multifunction \"Crown Complexes\" from Amino Acids and Peptides for Skin and Hair Restoration BIODERM RESEARCH (US) 2007-05-03 US disclosed
US-20050271608-A1 Skin whitening compositions based on hydroxyaryl alkyl ketones and their isosteric derivatives GUPTA SHYAM K 2005-12-08 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 (7 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-20140206905-A1 PROCESS FOR PREPARING CHIRAL QUINONE SQLE, TTPA, VAT1 THRB 3052/4885PRKCI 2712/4885CYP3A4 225/4885
US-20090074691-A1 Topical Delivery System for Antiaging and Skin Whitening Agents TYR, MMP17, MMP1 THRB 1199/4885PRKCI 2059/4885CYP3A4 1115/4885
US-20080287536-A1 Skin and Hair Restoration by Natural Amino Acid and Peptide Crown Complexes MMP17, MC1R, TYR THRB 1495/4885PRKCI 1537/4885CYP3A4 3806/4885
US-20180155311-A1 SEPARATION OF CHIRAL ISOMERS BY SFC VKORC1, VKORC1L1, TTPA THRB 1521/4885PRKCI 2716/4885CYP3A4 209/4885
US-20080254130-A1 Skin Antiaging & Brightening via Multi-function Treatment of Enzyme Dysfunction PSMB1, PLOD3, CUTA THRB 3874/4885PRKCI 887/4885CYP3A4 3624/4885
US-20090253668-A1 Hair Loss Prevention by Natural Amino Acid and Peptide Complexes MMP1, MMP17, MMP13 THRB 2047/4885PRKCI 2396/4885CYP3A4 4008/4885
US-20080255228-A1 Ascorbic Acid Complexes for Skin Care Including Treatment of Dark Skin & Wrinkles PROC, COL1A1, CUTA THRB 2502/4885PRKCI 667/4885CYP3A4 1140/4885

“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.