SCHEMBL8557225

SCHEMBL8557225

C[C]1CCC(C)(C)CC1

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
SCHEMBL10774832 0.80
SCHEMBL5949386 0.73
SCHEMBL2745940 0.71
SCHEMBL5432 0.71
SCHEMBL8397539 0.71
SCHEMBL5029773 0.69
SCHEMBL17625112 0.69 MAPT (0.36)
SCHEMBL307642 0.69
SCHEMBL2648270 0.69
SCHEMBL18574115 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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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
US-20170303540-A1 NOVEL TRIAZOLE DERIVATIVES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-10-26 US disclosed
CN-107001338-A The new triazole derivative as fungicide 拜耳作物科学股份公司 2017-08-01 CN disclosed
EP-0696564-B1 Refrigerant comprising polyol ether derivatives and production methods therefor KAO CORP (JP) 1998-12-23 EP disclosed
US-4698231-A Sweetening with L-aminodicarboxylic acid amides GENERAL FOOD CORPORATION (US) 1987-10-06 US disclosed
US-4678674-A Sweetening with L-aminodicarboxylic acid amides GENERAL FOODS CORPORATION (US) 1987-07-07 US disclosed
US-4676989-A Sweetening with cycloalkyl ethers and thioethers of dipeptides GENERAL FOODS CORPORATION (US) 1987-06-30 US disclosed
US-4654219-A ARTIFICIAL SWEETENERS GENERAL FOODS CORPORATION (US) 1987-03-31 US disclosed
US-4638071-A ARTIFICIAL SWEETENERS GENERAL FOODS CORPORATION (US) 1987-01-20 US disclosed
US-4636396-A Foodstuff with L-aminodicarboxylic acid gem-diamines GENERAL FOODS CORPORATION (US) 1987-01-13 US disclosed
US-4622417-A DIETETICS GENERAL FOODS CORPORATION (US) 1986-11-11 US disclosed
US-4622418-A LOW CALORIE SWEETENERS GENERAL FOODS CORPORATION (US) 1986-11-11 US disclosed
EP-0199258-A2 L-Aminodicarboxylic acid amides and an edible composition containing same GENERAL FOODS CORPORATION (US) 1986-10-29 EP disclosed
US-4619782-A L-aminodicarboxylic acid gem-diamines GENERAL FOODS CORPORATION (US) 1986-10-28 US disclosed
EP-0186173-A2 L-Aminodicarboxylic-(0-cycloalkyl)-L-aminocarboxylate alkyl esters, an edible composition containing same as sweeteners and a method for sweetening an edible composition GENERAL FOODS CORPORATION (US) 1986-07-02 EP disclosed
US-4572799-A L-Aminodicarboxylic acid amides GENERAL FOODS CORPORATION (US) 1986-02-25 US disclosed