SCHEMBL262580

SCHEMBL262580

C=CC(C)C=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
SCHEMBL8008332 1.00
SCHEMBL8351495 1.00
SCHEMBL11469440 0.80
SCHEMBL812256 0.76
SCHEMBL315431 0.76
SCHEMBL8895945 0.72
SCHEMBL7194547 0.69
SCHEMBL7194552 0.69
SCHEMBL7195125 0.69
SCHEMBL2163176 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11840539-B2 Substituted pyrrolo,-furano, and cyclopentylpyrimidines having antimitotic and/or antitumor activity and methods of use thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2023-12-12 US claimed
CN-114939438-B Method for selective hydrogenation of olefinic unsaturated carbonyl compound and catalyst thereof 山东新和成药业有限公司 2022-09-23 CN claimed
CN-114939438-A Method for selective hydrogenation of olefinic unsaturated carbonyl compound and catalyst thereof 山东新和成药业有限公司 2022-08-26 CN claimed
US-11186482-B2 Hydrogen generating system TEMASEK POLYTECHNIC (SG) 2021-11-30 US claimed
US-11091500-B2 Tricyclic compounds having antimitotic and/or antitumor activity and methods of use thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2021-08-17 US claimed
US-20210155633-A1 Substituted Pyrrolo,-Furano, and Cyclopentylpyrimidines Having Antimitotic and/or Antitumor Activity and Methods of Use Thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT 2021-05-27 US claimed
US-10947246-B2 Substituted pyrrolo, -furano, and cyclopentylpyrimidines having antimitotic and/or antitumor activity and methods of use thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2021-03-16 US claimed
CN-109280141-B Preparation method of fluorine-containing shrinkage-reduction type polycarboxylate superplasticizer 北京工业大学 2021-01-01 CN claimed
US-10676483-B2 Tricyclic compounds having antimitotic and/or antitumor activity and methods of use thereof DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2020-06-09 US claimed
EP-2310014-B1 TRICYCLIC COMPOUNDS HAVING ANTIMITOTIC AND/OR ANTITUMOR ACTIVITY AND METHODS OF USE THEREOF UNIV HOLY GHOST DUQUESNE (US) 2020-03-18 EP claimed
US-5977378-A Process for the preparation of 1-alkyl-pyrazole-5-carboxylic acid esters BAYER AKTIENGESELLSCHAFT (DE) 1999-11-02 US claimed
US-5976757-A CYCLES OF LAMINATION A PHOTPOLYMERIZABLE MATERIAL, EXPOSURE, DEVELOPMENT AGFA GEVAERT (BE) 1999-11-02 US claimed
US-5872292-A TOLUENEDIAMINE COMPOSITION WITH ALDEHYDES, KETONES, ACETALS AND KETALS BAYER CORPORATION (US) 1999-02-16 US claimed
EP-0890878-A2 Development material and process for the production of a negative colour proof, and process for the production of both a positive and negative colour proof on a single image-receiving material. AGFA-GEVAERT N.V. (BE) 1999-01-13 EP claimed
US-5705329-A SUPPORT WITH PHOTOGRAPHIC MATERIAL, POLYMER LAYER AND SILVER HALIDE EMULSION LAYER KONICA CORPORATION (JP) 1998-01-06 US claimed
US-5371253-A Process for producing esterified alkoxylated monoglycerides and diglycerides ARCO CHEMICAL TECHNOLOGY, L.P. (US) 1994-12-06 US claimed
US-5338633-A Electrophotographic photoreceptor MITSUBISHI KASEI CORPORATION (JP) 1994-08-16 US claimed
US-4695673-A Process for the production of acylated 1,3-dicarbonyl compounds STAUFFER CHEMICAL COMPANY (US) 1987-09-22 US claimed
EP-0053155-B1 METHOD FOR SEPARATING LIQUIDS FLOATING AT THE WATER SURFACE NEY, Inge (AT) 1985-01-02 EP claimed
US-4401571-A AMINE CURED EPOXY WITH RESIN FOAM FORMED IN SITU NEY KARL F (AT) 1983-08-30 US claimed