SCHEMBL952042

SCHEMBL952042

[O]CC1=CCCCC1

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
SCHEMBL1145670 0.97 CXCR3 (0.46)
SCHEMBL1145648 0.97
SCHEMBL951921 0.92
SCHEMBL953642 0.80
SCHEMBL8738283 0.79
SCHEMBL5320056 0.78 ALDH1A1 (0.52)
SCHEMBL1145933 0.77
SCHEMBL955333 0.77 ALDH1A1 (0.49)
SCHEMBL9419038 0.76 ALDH1A1 (0.50)
SCHEMBL2513477 0.76 ALDH1A1 (0.52)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10053539-B2 Composition for film formation, film, production method of patterned substrate, and compound JSR CORPORATION (JP) 2018-08-21 US claimed
US-4413001-A ANTIDEPRESSANTS DELALANDE S.A. (FR) 1983-11-01 US claimed
US-4348393-A ANTIDEPRESSANTS DELALANDE S.A. (FR) 1982-09-07 US claimed
US-10053539-B2 Composition for film formation, film, production method of patterned substrate, and compound JSR CORPORATION (JP) 2018-08-21 US disclosed
US-20180114698-A2 COMPOSITION FOR FILM FORMATION, FILM, PRODUCTION METHOD OF PATTERNED SUBSTRATE, AND COMPOUND JSR CORPORATION (JP) 2018-04-26 US disclosed
US-20170154782-A1 COMPOSITION FOR FILM FORMATION, FILM, PRODUCTION METHOD OF PATTERNED SUBSTRATE, AND COMPOUND JSR CORPORATION (JP) 2017-06-01 US disclosed
US-20150266839-A1 CYCLIC AMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2015-09-24 US disclosed
US-9139589-B2 Heteroaryls and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-09-22 US disclosed
US-20150225392-A1 CYCLIC AMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2015-08-13 US disclosed
US-9090601-B2 Thiazole derivatives MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-07-28 US disclosed
US-9072758-B2 Cyclic amide derivative MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2015-07-07 US disclosed
EP-1434485-A1 NICOTINIC ACID-HETEROCYCLYL-AMIDES AND ANALOGOUS PYRIMIDINE DERIVATIVES SERVING AS PESTICIDES Bayer CropScience GmbH (DE) 2004-07-07 EP disclosed
US-20040006047-A1 Heterocyclic amides, a process for their preparation, compositions comprising them and their use MERIAL LIMITED 2004-01-08 US disclosed
WO-2003028459-A1 NICOTINIC ACID-HETEROCYCLYL-AMIDES AND ANALOGOUS PYRIMIDINE DERIVATIVES SERVING AS PESTICIDES BAYER CROPSCIENCE GMBH (DE) 2003-04-10 WO disclosed
EP-1007515-A1 ARYLPYRIDAZINONES AS PROSTAGLANDIN ENDOPEROXIDE H SYNTHASE BIOSYNTHESIS INHIBITORS Abbott Laboratories (US) 2000-06-14 EP disclosed
WO-1999010331-A1 ARYLPYRIDAZINONES AS PROSTAGLANDIN ENDOPEROXIDE H SYNTHASE BIOSYNTHESIS INHIBITORS ABBOTT LABORATORIES (US) 1999-03-04 WO disclosed
US-4526786-A N-Substituted phenyl-5-aminomethyl oxazolidinones and their method of use DELALANDE S.A. (FR) 1985-07-02 US disclosed
US-4435415-A ANTIDEPRESSANTS DELALANDE S.A. (FR) 1984-03-06 US disclosed
US-4413001-A ANTIDEPRESSANTS DELALANDE S.A. (FR) 1983-11-01 US disclosed
US-4287351-A USEFUL AS ANTIDEPRESSANTS DELALANDE S.A. (FR) 1981-09-01 US disclosed