SCHEMBL1028174

SCHEMBL1028174

CC1[CH]C(C)(C)CCC1

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
SCHEMBL6226823 1.00
SCHEMBL10796645 0.92
SCHEMBL14108813 0.90
SCHEMBL1703037 0.83
SCHEMBL10581762 0.67
SCHEMBL10620386 0.67
SCHEMBL10798010 0.65 CYP1A2 (0.31)
SCHEMBL27774421 0.65
SCHEMBL10581831 0.65
SCHEMBL10896692 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230235113-A1 POLYMERS FOR HYDROPHOBIC AND OLEOPHOBIC TEXTILE FINISHING EVONIK OPERATIONS GMBH (DE) 2023-07-27 US claimed
EP-3580254-B1 POLYMERS FOR THE HYDROPHOBIC AND OLEOPHOBIC FINISHING OF TEXTILES EVONIK OPERATIONS GMBH (DE) 2022-05-11 EP claimed
US-20190330407-A1 POLYMERS FOR HYDROPHOBIC AND OLEOPHOBIC TEXTILE FINISHING EVONIK DEGUSSA GMBH (DE) 2019-10-31 US claimed
CN-110267998-A Polymer for hydrophobicity and oleophobic property textile finishing 赢创德固赛有限公司 2019-09-20 CN claimed
WO-2018146016-A1 POLYMERS FOR HYDROPHOBIC AND OELOPHOBIC TEXTILE FINISHING EVONIK DEGUSSA GMBH (DE) 2018-08-16 WO claimed
CN-107108897-A Organosilicon compounds 宝洁公司 2017-08-29 CN claimed
CN-103834034-B Polyureas copolymer with main chain containing siloxane composition unit and preparation method thereof 湖北大学 2017-02-08 CN claimed
CN-102448450-B Compositions comprising trans-tert-butyl cyclohexanol as skin irritation-reducing agent SYMRISE GMBH & CO KG 2013-11-20 CN claimed
CN-102079809-A Organosilicon modified high functionality polyisocyanate and water-based preparation method thereof HUBEI DEBANG CHEMICAL NEW MATERIALS CO LTD 2011-06-01 CN claimed
US-20100063238-A1 ISOCYANATE TRIMER MODIFIED WITH SILANE OR POLYSILOXANE AND METHOD OF PREPARAING THE SAME ZHANG QUNCHAO 2010-03-11 US claimed
EP-2157094-A1 AN ISOCYANATE TRIMER HAVING THE SILANE OR FUNCTIONAL POLYSILOCANE STRUCTURE AND THEIR PREPARATION METHODS Zhang, Qunchao (CN) 2010-02-24 EP claimed
EP-1347035-B1 Isomer composition containing optically active ethyl trans-2,2,6-trimethylcyclohexylcarboxylate and fragrance composition containing the isomer composition TAKASAGO PERFUMERY CO LTD (JP) 2008-07-23 EP claimed
CN-101050223-A Tripolymer in isocyanic ester class modified by silicane or functional polusiloxane, preparation method ZHANG QUNCHAO (CN) 2007-10-10 CN claimed
US-4692513-A FOODS AND BEVERAGES THE PROCTER & GAMBLE COMPANY (US) 1987-09-08 US claimed
US-4692512-A FOODS AND BEVERAGES THE PROCTER & GAMBLE COMPANY (US) 1987-09-08 US claimed
US-4517379-A ARTIFICIAL SWEETENER PFIZER INC. (US) 1985-05-14 US claimed
EP-4045095-B1 IRON (III) COMPLEXES WITH NOVEL CONTRAST PROPERTIES FOR MAGNETIC RESONANCE IMAGING UNIV BERLIN CHARITE (DE) 2023-08-02 EP disclosed
US-20230235113-A1 POLYMERS FOR HYDROPHOBIC AND OLEOPHOBIC TEXTILE FINISHING EVONIK OPERATIONS GMBH (DE) 2023-07-27 US disclosed
US-4073813-A PLATINUM REDUCTION CATALYST, ALDEHYDES, HYDROGEN RHONE-POULENC INDUSTRIES (FR) 1978-02-14 US disclosed
US-3994936-A Catalytic rearrangement HOFFMANN-LA ROCHE INC. (US) 1976-11-30 US disclosed