SCHEMBL3845264

SCHEMBL3845264

N#CC1CC2CC(C#N)C1C2

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
SCHEMBL4885514 0.82
SCHEMBL3911741 0.77
SCHEMBL3903020 0.77
SCHEMBL11701310 0.77
SCHEMBL3913041 0.77
SCHEMBL59800 0.68
Water SCHEMBL27908069 0.67
Water SCHEMBL27697076 0.67
SCHEMBL13588180 0.65
Ammonia Solution, Strong SCHEMBL28012319 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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016205405-A1 COORDINATION POLYMER NDSU RESEARCH FOUNDATION (US) 2016-12-22 WO claimed
WO-2016205405-A1 COORDINATION POLYMER NDSU RESEARCH FOUNDATION (US) 2016-12-22 WO disclosed
EP-2036883-B1 PROCESS FOR PRODUCING DICYANONORBORNANE MITSUI CHEMICALS INC (JP) 2012-10-17 EP disclosed
US-8183404-B2 Process for producing dicyanonorbornane and zerovalent nickel complex catalyst MITSUI CHEMICALS, INC. (JP) 2012-05-22 US disclosed
US-20090198082-A1 PROCESS FOR PRODUCING DICYANONORBORNANE AND ZEROVALENT NICKEL COMPLEX CATALYST MITSUI CHEMICALS , INC. (JP) 2009-08-06 US disclosed
EP-2036883-A1 PROCESS FOR PRODUCING DICYANONORBORNANE AND ZEROVALENT-NICKEL COMPLEX CATALYST Mitsui Chemicals, Inc. (JP) 2009-03-18 EP disclosed
EP-1086943-B1 A process for producing norbornane dimethylene amines MITSUI CHEMICALS INC (JP) 2003-01-02 EP disclosed
US-6262309-B1 FROM THE CORRESPONDING NITRILE COMPOUND; CATALYTIC HYDROGENATION MITSUI CHEMICALS, INC. (JP) 2001-07-17 US disclosed
EP-0417325-B1 PROCESS FOR PRODUCING NORCAMPHANEDICARBONITRILES MITSUI CHEMICALS INC (JP) 2001-07-11 EP disclosed
EP-1086943-A1 A process for producing norbornane dimethylene amines Mitsui Chemicals, Inc. (JP) 2001-03-28 EP disclosed
US-5596039-A FLAME RETARDERS, HEAT RESISTANCE MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1997-01-21 US disclosed
US-5569726-A USEFUL IN FLAME-RETARDING, THERMAL STABILIZATION AND COMPATIBILIZATION OF RESINS AND IN THERMOSETTING MOLDING COMPOSITIONS MITSUI TOATSU CHEMICALS, INC. (JP) 1996-10-29 US disclosed
US-5545702-A THERMOSETTING RESIN COMPOSITION MITSUI TOATSU CHEMICALS, INC. (JP) 1996-08-13 US disclosed
US-5536795-A ADHESIVES AND PAINTS AND FIREPROOFING THERMOSETTING RESINS MITSUI TOATSU CHEMICALS, INC. (JP) 1996-07-16 US disclosed
US-5480947-A N-METHYLOL DIGUANAMINES MITSUI TOATSU CHEMICALS, INC. (JP) 1996-01-02 US disclosed
EP-0634406-A1 DIGUANAMINE, AND PRODUCTION, DERIVATIVE AND USE THEREOF MITSUI TOATSU CHEMICALS, Inc. (JP) 1995-01-18 EP disclosed
EP-0612777-A2 Thermosetting molding and expansion-forming compositions MITSUI TOATSU CHEMICALS, Inc. (JP) 1994-08-31 EP disclosed
EP-0612797-A2 Modification method of resins MITSUI TOATSU CHEMICALS, Inc. (JP) 1994-08-31 EP disclosed
US-5169971-A Hydrocyanation; zero-valent nickel complex catalyst and a lewis acid; efficient; high selectivity MITSUI TOATSU CHEMICALS, INC. (JP) 1992-12-08 US disclosed
EP-0417325-A1 PROCESS FOR PRODUCING NORCAMPHANEDICARBONITRILES MITSUI TOATSU CHEMICALS, Inc. (JP) 1991-03-20 EP disclosed