SCHEMBL29402736

SCHEMBL29402736

COC(=O)c1ccccc1B(O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.59
LMNA P02545 1/20 0.59
ALDH1A1 P00352 1/20 0.57
CFTR P13569 1/20 0.57
HSD17B10 Q99714 1/20 0.57
KDM4E B2RXH2 1/20 0.55
POLB P06746 1/20 0.55
ATM Q13315 1/20 0.55
SLC6A3 Q01959 5/20 0.51
SLC6A4 P31645 3/20 0.51
MAPT P10636 3/20 0.50
KMT2A Q03164 2/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA5A P35218 1/20 0.50
CA9 Q16790 1/20 0.50
ALOX15 P16050 1/20 0.50
PTPRC P08575 1/20 0.49
SLC6A2 P23975 1/20 0.49
MYC P01106 1/20 0.49

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
SCHEMBL129359 1.00 TSHR (0.59) TSHRLMNAALDH1A1CFTRHSD17B10
SCHEMBL27314785 0.98 TSHR (0.57) TSHRLMNAALDH1A1CFTRHSD17B10
Hydrochloric Acid SCHEMBL3987321 0.98 TSHR (0.57) TSHRLMNAALDH1A1CFTRHSD17B10
SCHEMBL28411187 0.91 TSHR (0.50) TSHRLMNAALDH1A1CFTRHSD17B10
SCHEMBL31560156 0.82 CA1 (0.52) TSHRLMNAALDH1A1CFTRHSD17B10
SCHEMBL31463176 0.82 LMNA (0.48) TSHRLMNAALDH1A1CFTRHSD17B10
Dimethyl Phthalate SCHEMBL790124 0.82 TSHR (0.74) TSHRLMNAALDH1A1CFTRHSD17B10
Dimethyl Phthalate SCHEMBL29669976 0.82 TSHR (0.74) TSHRLMNAALDH1A1CFTRHSD17B10
Dimethyl Phthalate SCHEMBL29500970 0.82 TSHR (0.74) TSHRLMNAALDH1A1CFTRHSD17B10
Dimethyl Phthalate SCHEMBL34630 0.82 TSHR (0.74) TSHRLMNAALDH1A1CFTRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116514711-B New synthesis process of key intermediate of montelukast sodium 江苏阿尔法药业股份有限公司 2024-11-01 CN claimed
EP-4280882-A2 MATERIALS AND METHODS FOR EXTENDING SHELF-LIFE OF FOODS JP LABORATORIES, INC. (US) 2023-11-29 EP claimed
CN-116514711-A New synthesis process of key intermediate of montelukast sodium 江苏阿尔法药业股份有限公司 2023-08-01 CN claimed
CN-115873316-A Reconfigurable gutta-percha bidirectional shape memory material and preparation method and application thereof 北京化工大学 2023-03-31 CN claimed
WO-2022159439-A2 MATERIALS AND METHODS FOR EXTENDING SHELF-LIFE OF FOODS JP LABORATORIES, INC. (US) 2022-07-28 WO claimed
WO-2025088073-A1 HETEROCYCLIC COMPOUNDS AS BLT2 AGONISTS AND THEIR MEDICAL USE Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2025-05-01 WO disclosed
CN-119490494-B Aryl-substituted five-membered nitrogen heterocyclic amide derivative and application thereof 四川大学 2025-04-04 CN disclosed
CN-115594705-B Compound for organic photoelectric device, composition for organic photoelectric device, and display device 三星SDI株式会社 2025-03-25 CN disclosed
CN-119490494-A Aryl-substituted five-membered nitrogen heterocyclic amide derivative and application thereof 四川大学 2025-02-21 CN disclosed
EP-4472953-A1 ARYL HYDROCARBON RECEPTOR AGONISTS AND USES THEREOF Nexys Therapeutics, Inc. (US) 2024-12-11 EP disclosed
EP-4469446-A1 NEW HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2024-12-04 EP disclosed
CN-113631168-B GPR35 modulators 普罗米修斯生物科学公司 2024-11-19 CN disclosed
CN-113336735-B Urolithin compound, preparation method, pharmaceutical composition and application 常州大学 2022-09-30 CN disclosed
CN-114957229-A Arylamine compound and application thereof 广州追光科技有限公司 2022-08-30 CN disclosed
WO-2022174184-A1 PYRROLO[3,2-D]PYRIMIDINE COMPOUNDS AND METHODS OF USE IN THE TREATMENT OF CANCER TANGO THERAPEUTICS, INC. (US) 2022-08-18 WO disclosed
WO-2022159439-A2 MATERIALS AND METHODS FOR EXTENDING SHELF-LIFE OF FOODS JP LABORATORIES, INC. (US) 2022-07-28 WO disclosed
CN-114702495-A Purinones as ubiquitin-specific protease 1 inhibitors 福马治疗有限公司 2022-07-05 CN disclosed
CN-114685518-A Organic compound, mixture, composition and organic electronic device 广州华睿光电材料有限公司 2022-07-01 CN disclosed
CN-108473495-B Purinones as ubiquitin-specific protease 1 inhibitors 福马治疗有限公司 2022-04-12 CN disclosed
CN-113121364-B Nitrogen-containing compound, organic electroluminescent device, and electronic device 陕西莱特光电材料股份有限公司 2022-03-11 CN disclosed