Acetonitrile

Acetonitrile

SCHEMBL3613982

CC#N.COC(C)C#N

nearest known ligand 0.00

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⚠ 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
SCHEMBL6590316 0.94
SCHEMBL104305 0.94
SCHEMBL4741885 0.94
Acetonitrile SCHEMBL27785947 0.76
SCHEMBL23929031 0.75
Dimethylformamide SCHEMBL5510863 0.75 TSHR (0.41)
Acetonitrile SCHEMBL6245822 0.73
SCHEMBL6796444 0.73
SCHEMBL264243 0.69
Acetonitrile SCHEMBL9789841 0.68

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9064985-B2 Nickel-cobalt alloys as current collectors and conductive interconnects and deposition thereof on transparent conductive oxides BAR-ILAN UNIVERSITY (IL) 2015-06-23 US disclosed
US-20120181573-A1 TRANSPARENT CONDUCTIVE OXIDES HAVING A NANOSTRUCTURED SURFACE AND USES THEREOF BAR-ILAN UNIVERSITY (IL) 2012-07-19 US disclosed
US-7790067-B2 Electrophoretic deposition of nanosize titania crystals from a stable suspension onto a conductive substrate; treatment of with a nonionic surfactant in polar solvent to break/separate aggregated particles and enhance surfactant adsorption; mechanical/electrical contact; dye-sensitized solar cells 3GSOLAR LTD. (IL) 2010-09-07 US disclosed
US-20100065101-A1 NICKEL-COBALT ALLOYS AS CURRENT COLLECTORS AND CONDUCTIVE INTERCONNECTS AND DEPOSITION THEREOF ON TRANSPARENT CONDUCTIVE OXIDES BAR-ILAN UNIVERSITY (IL) 2010-03-18 US disclosed
US-20090133747-A1 COMPOUND HAVING PHOTOSENSITIZATION ACTIVITY, PHOTOELECTRODE, AND PHOTOSENSITIZATION-TYPE SOLAR CELL CREDIA JAPAN CO., LTD. ( A juridical person under the laws of Japan) (JP) 2009-05-28 US disclosed
US-20090114275-A1 Electrophoretic deposition of nanosize titania crystals from a stable suspension onto a conductive substrate; treatment of with a nonionic surfactant in polar solvent to break/separate aggregated particles and enhance surfactant adsorption; mechanical/electrical contact; dye-sensitized solar cells BARILAN UNIVERSITY (IL) 2009-05-07 US disclosed
EP-1900747-A1 COMPOUND HAVING PHOTOSENSITIZATION ACTIVITY, PHOTOELECTRODE, AND PHOTOSENSITIZATION-TYPE SOLAR CELL Credia Japan Co., Ltd. (JP) 2008-03-19 EP disclosed