SCHEMBL831272

SCHEMBL831272

[CH]=CC(C)=CC

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
SCHEMBL831271 1.00
SCHEMBL27835276 1.00
SCHEMBL11592781 0.73 ALDH1A1 (0.39)
SCHEMBL11592785 0.73 ALDH1A1 (0.39)
SCHEMBL23113008 0.70
SCHEMBL5894864 0.70
SCHEMBL5572770 0.69
SCHEMBL28323502 0.69
SCHEMBL4449119 0.67
SCHEMBL7276793 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6727381-B2 REACTING PHOSPHONATE COMPOUND WITH ALDEHYDE IN ORGANIC SOLVENT (HEXANE) IN PRESENCE OF A BASE (SODIUM TERT-BUTOXIDE) ZHEJIANG MEDICINE CO., LTD., XINCHANG PHARMACEUTICAL FACTORY (CN) 2004-04-27 US claimed
US-20020151742-A1 Process for producing vitamin a ester ZHEJIANG MEDICINE CO., LTD. (CN) 2002-10-17 US claimed
EP-0784639-B1 SYNDIOTACTIC PROCHIRAL OLEFIN POLYMERIZATION PROCESS DOW CHEMICAL CO (US) 1999-01-27 EP claimed
WO-1996018660-A1 HYDROGENATION OF UNSATURATED POLYMERS USING DIVALENT NON-AROMATIC ANIONIC DIENYL-CONTAINING GROUP IV METAL CATALYSTS THE DOW CHEMICAL COMPANY (US) 1996-06-20 WO claimed
EP-0224829-B1 POLYALLOOCIMENE AND METHOD FOR THE PREPARATION THEREOF Union Camp Corporation (US) 1990-07-25 EP claimed
US-4916250-A Phosphonate reagent compositions LOYOLA UNIVERSITY OF CHICAGO (US) 1990-04-10 US claimed
JP-2172997-A None JP disclosed
CN-109476680-B Organic magnesium phosphide, process for producing the same, complex thereof, process for producing the same, and process for producing organic phosphorus compound using the same 北兴化学工业株式会社 2022-06-28 CN disclosed
CN-107949625-B Hydrocarbon soluble/dispersible hemiformals as hydrogen sulfide scavengers 艺康美国股份有限公司 2020-10-02 CN disclosed
EP-3347441-B1 HYDROCARBON SOLUBLE/DISPERSIBLE HEMIFORMALS AS HYDROGEN SULFIDE SCAVENGERS ECOLAB USA INC (US) 2020-06-10 EP disclosed
US-10407626-B2 Hydrocarbon soluble/dispersible hemiformals as hydrogen sulfide scavengers ECOLAB USA INC. (US) 2019-09-10 US disclosed
US-20190248815-A1 ORGANIC MAGNESIUM PHOSPHIDE AND MANUFACTURING METHOD THEREOF, ORGANIC MAGNESIUM PHOSPHIDE COMPLEX AND MANUFACTURING METHOD THEREOF, AND MANUFACTURING METHOD OF ORGANIC PHOSPHORUS COMPOUND USING SAID PHOSPHIDE HOKKO CHEMICAL INDUSTRY CO., LTD. (JP) 2019-08-15 US disclosed
EP-3480204-A1 ORGANIC MAGNESIUM PHOSPHIDE AND METHOD FOR PRODUCING SAME, ORGANIC MAGNESIUM PHOSPHIDE COMPLEX AND METHOD FOR PRODUCING SAME, AND METHOD FOR PRODUCING ORGANIC PHOSPHORUS-CONTAINING COMPOUND USING SAID PHOSPHIDE Hokko Chemical Industry Co., Ltd. (JP) 2019-05-08 EP disclosed
US-4753998-A Diels-alder adducts of poly(aloocimene) UNION CAMP CORPORATION (US) 1988-06-28 US disclosed
US-4714706-A JUVENILE HORMONE INHIBITORS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-12-22 US disclosed
US-4694059-A Polyalloocimene and method for the preparation thereof UNION CAMP CORPORATION (US) 1987-09-15 US disclosed
EP-0224829-A1 Polyalloocimene and method for the preparation thereof Union Camp Corporation (US) 1987-06-10 EP disclosed
EP-0203798-A2 Nitrogen-containing heterocyclic compounds, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-12-03 EP disclosed
EP-0128028-A2 Cephalosporin derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1984-12-12 EP disclosed
US-4073813-A PLATINUM REDUCTION CATALYST, ALDEHYDES, HYDROGEN RHONE-POULENC INDUSTRIES (FR) 1978-02-14 US disclosed