SCHEMBL29707867

SCHEMBL29707867

CC(C)=CC(=O)OC1Cc2c(ccc3ccc(=O)oc23)OC1(C)C

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 14/20 0.76
▸ HPGD P15428 11/20 0.76
▸ CYP3A4 P08684 4/20 0.76
▸ HSD17B10 Q99714 4/20 0.76
▸ MAOA P21397 1/20 0.66
▸ ALDH1A1 P00352 12/20 0.64
▸ MAPT P10636 3/20 0.64
▸ MEN1 O00255 3/20 0.57
▸ KMT2A Q03164 3/20 0.57
▸ RCE1 Q9Y256 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ LMNA P02545 4/20 0.48
▸ HTT P42858 2/20 0.48
▸ NPSR1 Q6W5P4 2/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ RECQL P46063 1/20 0.48
▸ ABCB1 P08183 1/20 0.48
▸ GAA P10253 3/20 0.47
▸ TP53 P04637 2/20 0.47
▸ POLB P06746 1/20 0.47

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
SCHEMBL31349688 0.89 KDM4E (0.81) KDM4EHPGDCYP3A4HSD17B10MAOA
Jatamansin SCHEMBL14523891 0.86 KDM4E (1.00) KDM4EHPGDCYP3A4HSD17B10MAOA
Jatamansin SCHEMBL26671050 0.86 KDM4E (1.00) KDM4EHPGDCYP3A4HSD17B10MAOA
Jatamansin SCHEMBL30634819 0.86 KDM4E (1.00) KDM4EHPGDCYP3A4HSD17B10MAOA
Jatamansin SCHEMBL29385603 0.86 KDM4E (1.00) KDM4EHPGDCYP3A4HSD17B10MAOA
Jatamansin SCHEMBL12062120 0.86 KDM4E (1.00) KDM4EHPGDCYP3A4HSD17B10MAOA
Decursin SCHEMBL3904733 0.79 MAOA (1.00) KDM4EHPGDCYP3A4HSD17B10MAOA
Decursin SCHEMBL29912722 0.79 MAOA (1.00) KDM4EHPGDCYP3A4HSD17B10MAOA
Decursin SCHEMBL14511556 0.79 MAOA (1.00) KDM4EHPGDCYP3A4HSD17B10MAOA
Lomatin SCHEMBL6273711 0.79 KDM4E (1.00) KDM4EHPGDCYP3A4HSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115667518-A Recombinant microorganisms and methods 麦考瑞大学 2023-01-31 — — CN claimed
EP-4593977-A1 PRODUCTS AND METHODS RELATED TO THE DISTILLATION OF MOLECULES FROM AEROSOLS Natural Extraction Systems, LLC (US) 2025-08-06 — — EP disclosed
EP-4493552-A2 COMPOSITIONS AND METHODS RELATED TO THE SIMULTANEOUS MANUFACTURE AND PURIFICATION OF FLAVOR AND FRAGRANCE MOLECULES Natural Extraction Systems, LLC (US) 2025-01-22 — — EP disclosed
WO-2024073141-A1 PRODUCTS AND METHODS RELATED TO THE DISTILLATION OF MOLECULES FROM AEROSOLS Natural Extraction Systems, LLC (US) 2024-04-04 — — WO disclosed
WO-2024073142-A1 PRODUCTS AND METHODS RELATED TO THE DISTILLATION OF MOLECULES FROM AEROSOLS Natural Extraction Systems, LLC (US) 2024-04-04 — — WO disclosed
WO-2024073146-A2 COMPOSITIONS FOR LOW-TEMPERATURE DISTILLATION OF HIGH-BOILING-POINT MOLECULES Natural Extraction Systems, LLC (US) 2024-04-04 — — WO disclosed
WO-2023178172-A2 COMPOSITIONS AND METHODS RELATED TO THE SIMULTANEOUS MANUFACTURE AND PURIFICATION OF FLAVOR AND FRAGRANCE MOLECULES Natural Extraction Systems, LLC (US) 2023-09-21 — — WO disclosed
US-20230220121-A1 USE OF ALKANOLAMINES FOR LIGNIN EXTRACTION IN THE PRETREATMENT OF BIOMASS UNITED STATES DEPARTMENT OF ENERGY 2023-07-13 — — US disclosed
CN-115486396-A Crayfish ecological breeding method based on true and false aquatic weed biological function 江苏里下河地区农业科学研究所 2022-12-20 — — CN disclosed
CN-115058520-A Target sequence, primer pair and kit for identifying or assisting in identifying haemaphysalis lanuginosa and application of target sequence, primer pair and kit 中国农业科学院兰州兽医研究所 2022-09-16 — — CN disclosed
US-PP34323-P2 Quercus tree named ‘QNMTF2’ MOON DWAYNE (US) 2022-06-14 — — US disclosed
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