SCHEMBL9256573

SCHEMBL9256573

CCC1[CH]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
SCHEMBL2116824 1.00 SHBG (0.32)
SCHEMBL42612 0.97
SCHEMBL19537 0.90
SCHEMBL11639846 0.82 NAAA (0.35)
SCHEMBL14108975 0.81 CYP1A2 (0.38)
SCHEMBL14109108 0.81 CYP1A2 (0.38)
SCHEMBL61179 0.81
SCHEMBL1204684 0.79 NAAA (0.33)
SCHEMBL4388794 0.78
SCHEMBL14109298 0.78 CYP1A2 (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9075281-B2 Colored composition and image display structure FUJIFILM CORPORATION (JP) 2015-07-07 US claimed
US-20140293394-A1 COLORED COMPOSITION AND IMAGE DISPLAY STRUCTURE FUJIFILM CORPORATION (JP) 2014-10-02 US claimed
WO-2013100170-A2 COLORED COMPOSITION AND IMAGE DISPLAY STRUCTURE FUJIFILM CORPORATION (JP) 2013-07-04 WO claimed
EP-4045095-B1 IRON (III) COMPLEXES WITH NOVEL CONTRAST PROPERTIES FOR MAGNETIC RESONANCE IMAGING UNIV BERLIN CHARITE (DE) 2023-08-02 EP disclosed
EP-4045095-A1 IRON(III) COMPLEXES HAVING NEW CONTRAST AGENT PROPERTIES, FOR MAGNETIC RESONANCE IMAGING Charité - Universitätsmedizin Berlin (DE) 2022-08-24 EP disclosed
CN-109196034-B Polymer compositions comprising cycloalkylalkyl dicarboxylic diesters as plasticizers 巴斯夫欧洲公司 2021-06-08 CN disclosed
WO-2021074368-A1 IRON(III) COMPLEXES HAVING NEW CONTRAST AGENT PROPERTIES, FOR MAGNETIC RESONANCE IMAGING CHARITÉ - UNIVERSITÄTSMEDIZIN BERLIN (DE) 2021-04-22 WO disclosed
EP-3808381-A1 IRON (III) COMPLEXES WITH NOVEL CONTRAST PROPERTIES FOR MAGNETIC RESONANCE IMAGING Charité - Universitätsmedizin Berlin (DE) 2021-04-21 EP disclosed
EP-3762438-A1 BIOCIDAL COATING MATERIAL AND ASSOCIATED PRODUCTION PROCESS El Kudsi, Karim (DE) 2021-01-13 EP disclosed
US-10787565-B2 Polymer composition containing a cycloalkyl alkyl dicarboxylic acid diester as a plasticizer BASF SE (DE) 2020-09-29 US disclosed
CN-108699289-B Plasticizer composition comprising aliphatic dicarboxylic acid ester and diester selected from 1, 2-cyclohexane dicarboxylic acid ester and terephthalic acid ester 巴斯夫欧洲公司 2020-09-29 CN disclosed
US-4775692-A ANTILIPEMIC, ANTICOAGULANT, HYPOTENSIVE, ANTISECRETORY AND ANTIULCER AGENT TORAY INDUSTRIES, INC. (JP) 1988-10-04 US disclosed
EP-0274064-A2 2,5,6,7-Tetranor-18,18,19,19-tetradehydro-4,8-inter-m-phenylene PGI2 derivatives TORAY INDUSTRIES, INC. (JP) 1988-07-13 EP disclosed
EP-0232776-A2 2,5,6,7-tetranor-4,8-inter-m-phenylene PGI2 derivatives TORAY INDUSTRIES, INC. (JP) 1987-08-19 EP disclosed
US-4564620-A 5,6,7,-Trinor-4,8-inter-m-phenylene PGI2 derivatives and anti-ulcer, anti-thrombotic and anti-hypertensive pharmaceutical compositions containing them TORAY INDUSTRIES, INC. (JP) 1986-01-14 US disclosed
EP-0060640-B1 5,6,7-TRINOR-4,8-INTER-M-PHENYLENE PGI DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM TORAY INDUSTRIES, INC. (JP) 1985-11-13 EP disclosed
EP-0024943-B1 5,6,7-TRINOR-4,8-INTER-M-PHENYLENE PGI2 DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM TORAY INDUSTRIES, INC. (JP) 1983-08-17 EP disclosed
EP-0060640-A1 5,6,7-Trinor-4,8-inter-m-phenylene PGI derivatives and pharmaceutical compositions containing them TORAY INDUSTRIES, INC. (JP) 1982-09-22 EP disclosed
US-4301164-A FOR USE AS ANTIULCER AGENTS, HYPOTENSIVE AGENTS, ANTITHROMBOSIC AGENTS TORAY INDUSTRIES, INC. (JP) 1981-11-17 US disclosed
EP-0024943-A1 5,6,7-Trinor-4,8-inter-m-phenylene PGI2 derivatives and pharmaceutical compositions containing them TORAY INDUSTRIES, INC. (JP) 1981-03-11 EP disclosed