SCHEMBL2516449

SCHEMBL2516449

COc1ccc(C=Cc2cc(O)cc(OC)c2)cc1

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.86
CYP1A1 P04798 5/20 0.86
CYP1B1 Q16678 5/20 0.86
ALOX5 P09917 5/20 0.86
TTR P02766 3/20 0.86
KDM4E B2RXH2 3/20 0.85
PTGS1 P23219 3/20 0.85
LMNA P02545 1/20 0.85
ALOX12 P18054 1/20 0.85
NQO2 P16083 4/20 0.78
ABL1 P00519 3/20 0.78
BCR P11274 3/20 0.78
ESR1 P03372 2/20 0.78
ABCB1 P08183 2/20 0.78
CYP1A2 P05177 2/20 0.78
AHR P35869 2/20 0.78
CYP19A1 P11511 1/20 0.78
TUBB4A P04350 1/20 0.78
TUBB P07437 1/20 0.78
TUBA3C P0DPH7 1/20 0.78

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
SCHEMBL29652111 1.00 PTGS2 (0.86) PTGS2CYP1A1CYP1B1ALOX5TTR
SCHEMBL2516446 1.00 PTGS2 (0.86) PTGS2CYP1A1CYP1B1ALOX5TTR
SCHEMBL29662231 1.00 PTGS2 (0.86) PTGS2CYP1A1CYP1B1ALOX5TTR
SCHEMBL562335 0.92 CYP1A1 (1.00) PTGS2CYP1A1CYP1B1ALOX5TTR
SCHEMBL30475363 0.92 CYP1A1 (1.00) PTGS2CYP1A1CYP1B1ALOX5TTR
SCHEMBL562336 0.92 CYP1A1 (1.00) PTGS2CYP1A1CYP1B1ALOX5TTR
Resveratrol 4'-Methyl Ether SCHEMBL4732963 0.92 PTGS2 (1.00) PTGS2CYP1A1CYP1B1ALOX5TTR
Resveratrol 4'-Methyl Ether SCHEMBL563262 0.92 PTGS2 (1.00) PTGS2CYP1A1CYP1B1ALOX5TTR
Resveratrol 4'-Methyl Ether SCHEMBL563261 0.92 PTGS2 (1.00) PTGS2CYP1A1CYP1B1ALOX5TTR
SCHEMBL28899386 0.92 PTGS2 (0.73) PTGS2CYP1A1CYP1B1ALOX5TTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117801459-A High-toughness flame-retardant aging-resistant antistatic ABS material and preparation method thereof 浙江东吴新材料股份有限公司 2024-04-02 CN claimed
CN-114709406-B Sulfur-rich copolymer material, lithium sulfur battery positive electrode material, and preparation methods and applications thereof 中国电建集团成都勘测设计研究院有限公司 2023-07-25 CN claimed
CN-114709406-A Sulfur-rich copolymer material, lithium-sulfur battery positive electrode material, and preparation methods and applications thereof 中国电建集团成都勘测设计研究院有限公司 2022-07-05 CN claimed
CN-117801459-A High-toughness flame-retardant aging-resistant antistatic ABS material and preparation method thereof 浙江东吴新材料股份有限公司 2024-04-02 CN disclosed
US-20230309502-A1 ANIMAL LITTER COMPOSITIONS AND METHOD OF AMMONIA ABATEMENT CONTROLLED RELEASE TECHNOLOGIES, INC. (US) 2023-10-05 US disclosed
WO-2023158815-A1 ANIMAL LITTER COMPOSITIONS AND METHOD OF AMMONIA ABATMENT CONTROLLED RELEASE TECHNOLOGIES, INC. (US) 2023-08-24 WO disclosed
CN-114709406-B Sulfur-rich copolymer material, lithium sulfur battery positive electrode material, and preparation methods and applications thereof 中国电建集团成都勘测设计研究院有限公司 2023-07-25 CN disclosed
CN-114709406-A Sulfur-rich copolymer material, lithium-sulfur battery positive electrode material, and preparation methods and applications thereof 中国电建集团成都勘测设计研究院有限公司 2022-07-05 CN disclosed
US-9861564-B2 Valeric acid esters of resveratrol and cosmetic compositions ELC MANAGEMENT, LLC (US) 2018-01-09 US disclosed
US-9782335-B2 Malic acid esters of resveratrol and cosmetic compositions ELC MANAGEMENT LLC (US) 2017-10-10 US disclosed
US-20160303016-A1 Valeric Acid Esters Of Resveratrol And Cosmetic Compositions ELC MAN LLC (US) 2016-10-20 US disclosed
US-20090035243-A1 Anhydrous Cosmetic Compositions Containing Resveratrol Derivatives ELC MANAGEMENT LLC 2009-02-05 US disclosed
US-20090035240-A1 Aqueous Based Cosmetic Compositions Containing Resveratrol Derivatives And An Aqueous Phase Structuring Agent ELC MANAGEMENT LLC 2009-02-05 US disclosed
US-20090035242-A1 Emulsion Cosmetic Compositions Containing Resveratrol Derivatives And Linear Or Branched Silicone ELC MANAGEMENT LLC 2009-02-05 US disclosed
US-20090035237-A1 Emulsion Cosmetic Compositions Containing Resveratrol Derivatives And Silicone Surfactant ELC MANAGEMENT LLC 2009-02-05 US disclosed
US-20070248693-A1 Nutraceutical composition and method of use for treatment / prevention of cancer MAZZIO ELIZABETH 2007-10-25 US disclosed
US-20050240062-A1 Structural modification of resveratrol: Sodium resverastatin phosphate NATIONAL INSTITUTES OF HEALTH 2005-10-27 US disclosed
US-20050240062-A1 Structural modification of resveratrol: Sodium resverastatin phosphate NATIONAL INSTITUTES OF HEALTH 2005-10-27 US disclosed
WO-2003086414-A1 STRUCTURAL MODIFICATION OF RESVERATROL: SODIUM RESVERASTATIN PHOSPHATE ARIZONA BOARD OF REGENTS (US) 2003-10-23 WO disclosed
WO-2003086414-A1 STRUCTURAL MODIFICATION OF RESVERATROL: SODIUM RESVERASTATIN PHOSPHATE ARIZONA BOARD OF REGENTS (US) 2003-10-23 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 (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-20090035243-A1 Anhydrous Cosmetic Compositions Containing Resveratrol Derivatives RB1, SIRT1, EP300 PTGS2 3838/4885CYP1A1 1440/4885CYP1B1 902/4885
US-20090035242-A1 Emulsion Cosmetic Compositions Containing Resveratrol Derivatives And Linear Or Branched Silicone SQLE, SMURF1, PIK3R1 PTGS2 3228/4885CYP1A1 2625/4885CYP1B1 1478/4885
US-20050240062-A1 Structural modification of resveratrol: Sodium resverastatin phosphate PI4KB, HDAC4, PIK3CA PTGS2 3996/4885CYP1A1 3525/4885CYP1B1 2430/4885
US-20160303016-A1 Valeric Acid Esters Of Resveratrol And Cosmetic Compositions CUTA, SUV39H1, RARA PTGS2 2796/4885CYP1A1 348/4885CYP1B1 428/4885
US-20090035237-A1 Emulsion Cosmetic Compositions Containing Resveratrol Derivatives And Silicone Surfactant SMURF1, CUTA, SMURF2 PTGS2 3901/4885CYP1A1 2419/4885CYP1B1 2175/4885
US-20070248693-A1 Nutraceutical composition and method of use for treatment / prevention of cancer DLD, DERA, ALDOA PTGS2 1380/4885CYP1A1 1403/4885CYP1B1 1227/4885
US-20090035240-A1 Aqueous Based Cosmetic Compositions Containing Resveratrol Derivatives And An Aqueous Phase Structuring Agent SMARCC1, RARG, RARA PTGS2 3031/4885CYP1A1 1950/4885CYP1B1 1679/4885

“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.