SCHEMBL933491

SCHEMBL933491

B(OCCc1ccccc1)OCCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.50
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
IDO1 P14902 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
ALOX12 P18054 1/20 0.46
CASP1 P29466 1/20 0.46
HSD17B10 Q99714 1/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
CYP2A6 P11509 1/20 0.44
HTR2A P28223 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TAAR1 Q96RJ0 1/20 0.44
LOXL2 Q9Y4K0 1/20 0.44
HCAR2 Q8TDS4 1/20 0.41
MAOA P21397 1/20 0.41

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
SCHEMBL9223456 0.86 IDO1 (0.59) TDP1IDO1NPC1RAB9AHTR2A
SCHEMBL2457870 0.81 TDP1 (0.52) TDP1CA1CA2CA9IDO1
SCHEMBL910723 0.76 CYP1A2 (0.48) TDP1IDO1ALDH1A1ALOX15CYP2A6
SCHEMBL9222896 0.76 TAAR1 (0.48) IDO1CYP2A6HTR2ATAAR1MAOA
SCHEMBL198134 0.76 TSHR (0.52) TDP1CA1CA2CA9IDO1
SCHEMBL6341147 0.76 ALDH1A1 (0.52) TDP1CA1CA2CA9IDO1
SCHEMBL7038839 0.74 CA1 (0.50) TDP1CA1CA2CA9IDO1
SCHEMBL723193 0.74 TSHR (0.57) TDP1CA1CA2CA9IDO1
SCHEMBL21987926 0.74 ALDH1A1 (0.50) TDP1CA1CA2CA9IDO1
SCHEMBL5946547 0.72 CA1 (0.48) TDP1CA1CA2CA9IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4263677-B1 METHODS AND SYSTEMS FOR PRODUCTION OF FURFURAL SHELL INT RESEARCH (NL) 2024-10-30 EP claimed
EP-4263676-B1 METHODS AND SYSTEMS FOR PRODUCTION OF FURFURAL SHELL INT RESEARCH (NL) 2024-10-30 EP claimed
US-20240025871-A1 METHODS AND SYSTEMS FOR PRODUCTION OF FURFURAL SHELL USA, INC. 2024-01-25 US claimed
CN-111491939-B Immunoproteasome inhibitors 普林斯匹亚生物制药公司 2023-12-26 CN claimed
EP-4280882-A2 MATERIALS AND METHODS FOR EXTENDING SHELF-LIFE OF FOODS JP LABORATORIES, INC. (US) 2023-11-29 EP claimed
EP-4263677-A1 METHODS AND SYSTEMS FOR PRODUCTION OF FURFURAL Shell Internationale Research Maatschappij B.V. (NL) 2023-10-25 EP claimed
EP-4263676-A1 METHODS AND SYSTEMS FOR PRODUCTION OF FURFURAL Shell Internationale Research Maatschappij B.V. (NL) 2023-10-25 EP claimed
WO-2022159439-A2 MATERIALS AND METHODS FOR EXTENDING SHELF-LIFE OF FOODS JP LABORATORIES, INC. (US) 2022-07-28 WO claimed
WO-2022133271-A1 METHODS AND SYSTEMS FOR PRODUCTION OF FURFURAL SHELL OIL COMPANY (US) 2022-06-23 WO claimed
US-20220194914-A1 METHODS AND SYSTEMS FOR PRODUCTION OF FURFURAL SHELL OIL COMPANY 2022-06-23 US claimed
WO-2022133243-A1 METHODS AND SYSTEMS FOR PRODUCTION OF FURFURAL SHELL OIL COMPANY (US) 2022-06-23 WO claimed
US-20100236924-A1 LIQUID ELECTROLYTE COMPOSITION AND ITS USE IN GAS SENSORS LIFE SAFETY DISTRIBUTION AG (CH) 2010-09-23 US claimed
EP-2226627-A1 Liquid electrolyte composition and its use in gas sensors Life Safety Distribution AG (CH) 2010-09-08 EP claimed
WO-1995005081-A1 BIOCIDAL COMPOSITIONS CONTAINING ORGANOBORON COMPOUNDS U.S. BORAX INC. (US) 1995-02-23 WO claimed
EP-4263676-B1 METHODS AND SYSTEMS FOR PRODUCTION OF FURFURAL SHELL INT RESEARCH (NL) 2024-10-30 EP disclosed
EP-4263677-B1 METHODS AND SYSTEMS FOR PRODUCTION OF FURFURAL SHELL INT RESEARCH (NL) 2024-10-30 EP disclosed
US-20240025871-A1 METHODS AND SYSTEMS FOR PRODUCTION OF FURFURAL SHELL USA, INC. 2024-01-25 US disclosed
EP-0199260-B1 BORONIC ACID ADDUCTS OF TECHNETIUM-99M DIOXIME COMPLEXES E.R. Squibb & Sons, Inc. (US) 1989-12-06 EP disclosed
US-4705849-A Boronic acid adducts of technetium-99m dioxime complexes E. R. SQUIBB & SONS, INC. (US) 1987-11-10 US disclosed
EP-0199260-A2 Boronic acid adducts of technetium-99M dioxime complexes E.R. Squibb & Sons, Inc. (US) 1986-10-29 EP disclosed