SCHEMBL526347

SCHEMBL526347

[CH2]COc1[c]cccc1

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
SCHEMBL8583545 0.83
SCHEMBL1923112 0.82
SCHEMBL6238419 0.81 JAK2 (0.33)
SCHEMBL4353344 0.78 KCNA3 (0.34)
SCHEMBL4354869 0.78 KCNA3 (0.34)
SCHEMBL4358076 0.78 KCNA3 (0.34)
SCHEMBL49802 0.77
SCHEMBL9031950 0.77
SCHEMBL1006142 0.77
SCHEMBL584941 0.77

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
US-5246932-A Adenosine antagonist such as vasodilation IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-09-21 US claimed
EP-0515108-A2 Azolo (1,3,5) triazines as adenosine antagonists ZENECA LIMITED (GB) 1992-11-25 EP claimed
WO-2023136269-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2023-07-20 WO disclosed
EP-2492301-B1 NOVEL CO-MODIFIED ORGANOPOLYSILOXANE DOW TORAY CO LTD (JP) 2023-03-29 EP disclosed
CN-110546560-B Liquid crystal aligning agent, liquid crystal alignment film, and liquid crystal display element 日产化学株式会社 2022-08-19 CN disclosed
EP-3009466-B1 SILICONE MODIFIED BY LONG-CHAIN HYDROCARBON GROUP-CONTAINING DIGLYCERIN DERIVATIVE, AND USE THEREOF DOW TORAY CO LTD (JP) 2021-02-24 EP disclosed
CN-110546560-A Liquid crystal aligning agent, liquid crystal alignment film, and liquid crystal display element NISSAN CHEMICAL CORP 2019-12-06 CN disclosed
US-10406092-B2 Method for producing transparent or semi-transparent liquid glycerin-derivative-modified silicone composition DOW SILICONES CORPORATION (US) 2019-09-10 US disclosed
EP-2797992-B1 DIGLYCERIN DERIVATE-MODIFIED SILICONE, EMULSIFIER FOR WATER-IN-OIL EMULSION USING THE SAME, EXTERNAL USE PREPARATION, AND COSMETIC COMPOSITION DOW CORNING TORAY CO LTD (JP) 2019-04-17 EP disclosed
US-10174170-B2 Method for producing liquid high-purity polyhydric alcohol derivative-modified silicone or composition thereof DOW CORNING TORAY CO., LTD. (JP) 2019-01-08 US disclosed
EP-2492300-B1 NOVEL ORGANOPOLYSILOXANE COPOLYMER DOW CORNING TORAY CO LTD (JP) 2018-10-03 EP disclosed
EP-0502022-B1 COMPOSITE POLYESTER FILMS RHONE-POULENC FILMS (FR) 1993-09-29 EP disclosed
US-5246932-A Adenosine antagonist such as vasodilation IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-09-21 US disclosed
EP-0515108-A2 Azolo (1,3,5) triazines as adenosine antagonists ZENECA LIMITED (GB) 1992-11-25 EP disclosed
EP-0502022-A1 COMPOSITE POLYESTER FILMS. RHONE POULENC FILMS (FR) 1992-09-09 EP disclosed
EP-0430828-A1 Sulphonated copolyesters having siloxane units RHONE-POULENC CHIMIE (FR) 1991-06-05 EP disclosed
WO-1991007456-A1 COMPOSITE POLYESTER FILMS RHONE-POULENC FILMS (FR) 1991-05-30 WO disclosed
EP-0126149-A1 ANALYTICAL ELEMENT CONTAINING A BARRIER ZONE AND PROCESS EMPLOYING SAME EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1984-11-28 EP disclosed
WO-1984002192-A1 ANALYTICAL ELEMENT CONTAINING A BARRIER ZONE AND PROCESS EMPLOYING SAME EASTMAN KODAK CO (US) 1984-06-07 WO disclosed
US-3960814-A SEALS, DINITRILE COMPOUND THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 1976-06-01 US disclosed