SCHEMBL457306

SCHEMBL457306

COc1[c]ccc(C)c1C

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
SCHEMBL8196392 0.79 KDM4E (0.32)
SCHEMBL1849617 0.79 CA12 (0.35)
SCHEMBL11278659 0.77
SCHEMBL5329541 0.77 TUBB1 (0.30)
SCHEMBL17698455 0.77
SCHEMBL8120627 0.77 ALDH1A1 (0.31)
SCHEMBL9244853 0.76 NQO1 (0.36)
SCHEMBL8528998 0.74 SMN1; SMN2 (0.44)
SCHEMBL9672520 0.74 KDM4E (0.35)
SCHEMBL12816609 0.74 CA1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4763771-B2 2011-08-31 JP claimed
EP-1861352-B1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-PHENYLPROPIONIC ACID DERIVATIVES AND FOLLOW-ON PRODUCTS OF THE LATTER BASF SE (DE) 2009-12-09 EP claimed
US-20080171892-A1 Method for Producing Optically Active 3-Phenylpropionic Acid Derivatives and Follow-On Products of the Latter BASF AKTIENGESELLSCHAFT (DE) 2008-07-17 US claimed
EP-1861352-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-PHENYLPROPIONIC ACID DERIVATIVES AND FOLLOW-ON PRODUCTS OF THE LATTER BASF AKTIENGESELLSCHAFT (DE) 2007-12-05 EP claimed
WO-2006097314-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-PHENYLPROPIONIC ACID DERIVATIVES AND FOLLOW-ON PRODUCTS OF THE LATTER BASF AKTIENGESELLSCHAFT (DE) 2006-09-21 WO claimed
US-4567197-A THORMBOXANE A2 ANTAGONISTS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-01-28 US claimed
CN-116438214-A Sealing material for organic EL display element, cured product thereof, and organic EL display device 三井化学株式会社 2023-07-14 CN disclosed
CN-114815504-A Colored curable resin composition 住友化学株式会社 2022-07-29 CN disclosed
WO-2021261133-A1 PHOTOCURABLE COMPOSITION, CURED PRODUCT THEREOF, AND METHOD FOR PRODUCING CURED PRODUCT 東亞合成株式会社 2021-12-30 WO disclosed
EP-3045450-B1 INTERMEDIATE COMPOUNDS IN PROCESSES FOR PRODUCING PYRIDAZINONE COMPOUNDS SUMITOMO CHEMICAL CO (JP) 2018-02-07 EP disclosed
US-20170079954-A1 PHARMACEUTICALLY ACCEPTABLE SALTS OF 3,5-DIAMINOPYRAZOLE KINASE INHIBITORS AXIKIN PHARMACEUTICALS, INC. 2017-03-23 US disclosed
US-9540351-B2 Pharmaceutically acceptable salts of 3,5-diaminopyrazole kinase inhibitors AXIKIN PHARMACEUTICALS, INC. (US) 2017-01-10 US disclosed
CN-104277004-B Prepare method and its intermediate of pyridazinone compound 住友化学株式会社 2016-08-24 CN disclosed
US-4567197-A THORMBOXANE A2 ANTAGONISTS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-01-28 US disclosed
EP-0007468-B1 COMPOSITIONS PHOTODURCISSABLES CIBA-GEIGY AG (CH) 1982-04-07 EP disclosed
US-4284485-A STABILIZED WITH A POLYALKYLPIPERIDINE DERIVATIVE CIBA-GEIGY CORPORATION (US) 1981-08-18 US disclosed
US-4279720-A PHENYLGLYOXYLATE PHOTOINITIATOR WITH POLYALKYLPIPERIDINE STABILIZER CIBA-GEIGY CORPORATION (US) 1981-07-21 US disclosed
EP-0007059-B1 PHOTOCURABLE COMPOSITIONS CIBA-GEIGY AG (CH) 1981-04-15 EP disclosed
EP-0007468-A1 Compositions photodurcissables CIBA-GEIGY AG (CH) 1980-02-06 EP disclosed
EP-0007059-A1 Photocurable compositions CIBA-GEIGY AG (CH) 1980-01-23 EP disclosed