SCHEMBL7821165

SCHEMBL7821165

CCC(C)(C#N)CC

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
SCHEMBL2032709 1.00
Boric Acid SCHEMBL27935966 0.88 TSHR (0.30)
SCHEMBL8760777 0.84
SCHEMBL1148058 0.84
SCHEMBL23054517 0.82
SCHEMBL13811907 0.82
SCHEMBL10127534 0.82
SCHEMBL2618664 0.82
SCHEMBL5621935 0.82
SCHEMBL9541878 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3171421-B1 ORGANIC LIGHT-EMITTING ELEMENT UNIV KYUSHU NAT UNIV CORP (JP) 2023-01-25 EP disclosed
CN-114085163-A Method for synthesizing 2,3,3, 3-tetrafluoro-2- (trifluoromethyl) propionitrile by gas-phase catalytic fluorination 化学与精细化工广东省实验室 2022-02-25 CN disclosed
US-11254688-B2 Benzyl-, (pyridin-3-yl)methyl -or (pyridin-4-yl)-methyl-substituted oxadiazolopyridine derivatives as ghrelin O-acyl transferase (GOAT) inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2022-02-22 US disclosed
US-20210053985-A1 BENZYL-, (PYRIDIN-3-YL)METHYL -OR (PYRIDIN-4-YL)-METHYL-SUBSTIITUTED OXADIAZOLOPYRIDINE DERIVATIVES AS GHRELIN O-ACYL TRANSFERASE (GOAT) INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2021-02-25 US disclosed
WO-2021012049-A1 SUBSTITUTED 2-MORPHOLINOPYRIDINE DERIVATIVES AS ATR KINASE INHIBITORS REPARE THERAPEUTICS INC. (CA) 2021-01-28 WO disclosed
EP-3266468-B1 EYEDROPS NOF CORP (JP) 2020-10-14 EP disclosed
US-20190173020-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES Kyulux North America, Inc. 2019-06-06 US disclosed
US-20180110223-A1 PHENOXY- OR PYRIDIN-2-YLOXY-AMINOTRIAZINE COMPOUNDS AND THEIR USE AS HERBICIDES BASF SE (DE) 2018-04-26 US disclosed
US-20180105531-A1 METHODS AND COMPOSITIONS FOR INHIBITING THE INTERACTION OF MENIN WITH MLL PROTEINS WELLSPRING BIOSCIENCES LLC 2018-04-19 US disclosed
US-20170213974-A1 ORGANIC LIGHT-EMITTING DEVICE, HOST MATERIAL, LIGHT-EMITTING MATERIAL, AND COMPOUND KYULUX, INC. (JP) 2017-07-27 US disclosed
EP-1090005-A1 PYRAZOLO 1,5-a]TRIAZINE CORTICOTROPIN RELEASING FACTOR ANTAGONISTS Du Pont Pharmaceuticals Company (US) 2001-04-11 EP disclosed
WO-1999067247-A1 PYRAZOLO[1,5-a]TRIAZINE CORTICOTROPIN RELEASING FACTOR ANTAGONISTS DU PONT PHARMACEUTICALS COMPANY (US) 1999-12-29 WO disclosed
US-5972841-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1999-10-26 US disclosed
US-5665716-A 24-homo vitamin D derivatives, process for their production and pharmaceutical preparations obtained therefrom SCHERING AKTIENGESELLSCHAFT (DE) 1997-09-09 US disclosed
EP-0421561-B1 24-D-homo-vitamin D-derivatives, a process for their production, pharmaceutical compositions containing them and their use as medicines SCHERING AG (DE) 1994-04-06 EP disclosed
US-5154755-A Uracil derivatives and herbicides containing the same as active ingredient NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1992-10-13 US disclosed
EP-0421561-A2 24-D-homo-vitamin D-derivatives, a process for their production, pharmaceutical compositions containing them and their use as medicines SCHERING AKTIENGESELLSCHAFT (DE) 1991-04-10 EP disclosed
EP-0208921-A2 Hydroformylation of olefinic compounds in the presence of soluble cobalt salt catalysts and an organic nitrile promoter HENKEL CORPORATION (a Delaware corp.) (US) 1987-01-21 EP disclosed
US-4612403-A Hydroformylation of olefinic compounds in the presence of a cobalt catalyst and an organic nitrile promoter HENKEL CORPORATION (US) 1986-09-16 US disclosed
US-4219684-A REACTION OF AN OLEFIN WITH CARBON MONOXIDE AND HYDROGEN UOP INC. (US) 1980-08-26 US disclosed