SCHEMBL95498

SCHEMBL95498

CC(C)([O])CC(=O)O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL4108336 0.78
SCHEMBL7252624 0.76 HMGCR (0.61)
SCHEMBL30854909 0.76 KDM4E (0.65)
T-Butylacetic Acid SCHEMBL10950588 0.76 HMGCR (0.61)
SCHEMBL544642 0.76 HMGCR (0.61)
T-Butylacetic Acid SCHEMBL71379 0.76
SCHEMBL48109 0.76 KDM4E (0.65)
SCHEMBL11439787 0.73 KDM4E (0.62)
T-Butylacetic Acid SCHEMBL973430 0.73
SCHEMBL6733907 0.73 KDM4E (0.62)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113227258-B Azo compound or salt thereof, and dye-based polarizing film and dye-based polarizing plate each containing the same 日本化药株式会社 2024-02-06 CN disclosed
CN-114072392-A Luminescent compound or salt thereof, and polarized light-emitting element, polarized light-emitting panel, and display device each containing the same 日本化药株式会社 2022-02-18 CN disclosed
CN-113993854-A Luminescent compound or salt thereof, and polarized light-emitting element, polarized light-emitting panel, and display device using same 日本化药株式会社 2022-01-28 CN disclosed
CN-113924289-A Luminescent compound or salt thereof, and polarized light-emitting element, polarized light-emitting panel, and display device each containing the same 日本化药株式会社 2022-01-11 CN disclosed
CN-113227258-A Azo compound or salt thereof, and dye-based polarizing film and dye-based polarizing plate containing the same 日本化药株式会社 2021-08-06 CN disclosed
WO-2020137691-A1 AZO COMPOUND OR SALT THEREOF, AND DYE-BASED POLARIZING FILM AND DYE-BASED POLARIZING PLATE EACH CONTAINING SAME 日本化薬株式会社 2020-07-02 WO disclosed
EP-1957073-B1 MEDICINAL DRUG OTSUKA PHARMA CO LTD (JP) 2014-04-23 EP disclosed
EP-2612858-A1 STAT3/5 activation inhibitor OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-07-10 EP disclosed
US-8362252-B2 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-01-29 US disclosed
US-8354439-B2 Agent for inhibition of cytokine production and agent for inhibition of cell adhesion OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-01-15 US disclosed
WO-1994001113-A1 OXYTOCIN ANTAGONIST OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1994-01-20 WO disclosed
US-5244898-A Vasopressin antagonist OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-09-14 US disclosed
US-5225402-A Vasopressin antagonist, vasodilation, hypotensive, diuretics and anticoagulants OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-07-06 US disclosed
EP-0514667-A1 Benzazepin derivatives as vasopressin antagonists OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-11-25 EP disclosed
EP-0513387-A1 ACTIVE OXYGEN INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-11-19 EP disclosed
WO-1991005549-A1 BENZOHETEROCYCLIC COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-05-02 WO disclosed
EP-0382185-A2 Carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-08-16 EP disclosed
US-4760064-A Cardiotonic agent OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-07-26 US disclosed
EP-0187322-A1 Carbostyril compounds, compositions containing same and processes for preparing same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-07-16 EP disclosed
EP-0122158-A2 Improvements in or relating to benzothienyl cephalosporin antibiotics ELI LILLY AND COMPANY (US) 1984-10-17 EP disclosed