SCHEMBL395631

SCHEMBL395631

c1ccc(C2CCCC3CCCCC32)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CHRNA7 P36544 1/20 0.41
MAOA P21397 7/20 0.40
MAOB P27338 7/20 0.40
KDM1A O60341 6/20 0.40
CYP2C19 P33261 4/20 0.40
CYP2B6 P20813 3/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2D6 P10635 2/20 0.40
CYP2C9 P11712 2/20 0.40
TAAR1 Q96RJ0 2/20 0.40
LMNA P02545 1/20 0.40
SLC18A3 Q16572 1/20 0.40
CYP3A4 P08684 1/20 0.40
HTR1A P08908 1/20 0.40
ADRA2A P08913 1/20 0.40
CYP2A6 P11509 1/20 0.40
SLC6A2 P23975 1/20 0.40
HTR2C P28335 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL13735039 1.00 MEN1 (0.47) MEN1KMT2ACHRNA7MAOAMAOB
SCHEMBL10736010 0.96 MEN1 (0.47) MEN1KMT2ACHRNA7MAOAMAOB
SCHEMBL418730 0.96 MEN1 (0.47) MEN1KMT2ACHRNA7MAOAMAOB
SCHEMBL10751690 0.96 MEN1 (0.47) MEN1KMT2ACHRNA7MAOAMAOB
SCHEMBL10751693 0.96 MEN1 (0.47) MEN1KMT2ACHRNA7MAOAMAOB
SCHEMBL6389916 0.92 MEN1 (0.44) MEN1KMT2ACHRNA7MAOAMAOB
SCHEMBL28843512 0.92 CHRNA7 (0.41) MEN1KMT2ACHRNA7MAOAMAOB
SCHEMBL20547511 0.81 MAOB (0.46) MEN1KMT2ACHRNA7MAOAMAOB
SCHEMBL28533430 0.80 MEN1 (0.30) MEN1KMT2A
SCHEMBL27855900 0.80 HTT (0.41) KMT2ACYP2D6CYP2C9LMNASLC18A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024126635-A1 FORMULATION OF AN ORGANIC FUNCTIONAL MATERIAL MERCK PATENT GMBH (DE) 2024-06-20 WO disclosed
EP-4326826-A1 FORMULATION OF AN ORGANIC FUNCTIONAL MATERIAL Merck Patent GmbH (DE) 2024-02-28 EP disclosed
CN-117178031-A Preparation of organic functional material 默克专利有限公司 2023-12-05 CN disclosed
EP-3807367-B1 FORMULATION OF AN ORGANIC FUNCTIONAL MATERIAL MERCK PATENT GMBH (DE) 2023-07-19 EP disclosed
CN-109890939-B Preparation of organic functional material 默克专利有限公司 2023-07-11 CN disclosed
US-20230151235-A1 FORMULATION OF AN ORGANIC FUNCTIONAL MATERIAL MERCK PATENT GMBH (DE) 2023-05-18 US disclosed
US-11603479-B2 Formulation of an organic functional material MERCK KGAA (DE) 2023-03-14 US disclosed
EP-4139408-A1 FORMULATION OF AN ORGANIC FUNCTIONAL MATERIAL Merck Patent GmbH (DE) 2023-03-01 EP disclosed
CN-115427521-A Preparation of organic functional material 默克专利有限公司 2022-12-02 CN disclosed
WO-2022223675-A1 FORMULATION OF AN ORGANIC FUNCTIONAL MATERIAL MERCK PATENT GMBH (DE) 2022-10-27 WO disclosed
CN-101258130-A Isoquinolines as insulin-like growth factor-1 receptor inhibitors ANALYTECON SA (CH) 2008-09-03 CN disclosed
EP-1196454-B1 MAGNESIUM/TITANIUM ALKOXIDE COMPLEXES AND POLYMERIZATION CATALYSTS MADE THEREFROM UNION CARBIDE CHEM PLASTIC (US) 2005-11-16 EP disclosed
US-6913797-B1 Decahydronaphthalene derivative DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-07-05 US disclosed
EP-1196454-A1 MAGNESIUM/TITANIUM ALKOXIDE COMPLEXES AND POLYMERIZATION CATALYSTS MADE THEREFROM UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 2002-04-17 EP disclosed
US-20010039241-A1 Magnesium/titanium alkoxide compounds and method of preparation JOB ROBERT CHARLES (US) 2001-11-08 US disclosed
EP-1108700-A1 DECAHYDRONAPHTHALENE DERIVATIVE DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-06-20 EP disclosed
WO-2001000687-A1 MAGNESIUM/TITANIUM ALKOXIDE COMPLEXES AND POLYMERIZATION CATALYSTS MADE THEREFROM UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 2001-01-04 WO disclosed
JP-2000239214-A DECAHYDRONAPHTHALENE DERIVATIVE AND ITS PRODUCTION DAINIPPON INK & CHEM INC 2000-09-05 JP disclosed
JP-2000229896-A DECAHYDRONAPHTHALENE DERIVATIVE DAINIPPON INK & CHEM INC 2000-08-22 JP disclosed
JP-2000226344-A PHENYLDECAHYDRONAPHTHALENE DERIVATIVE DAINIPPON INK & CHEM INC 2000-08-15 JP disclosed