SCHEMBL5175685

SCHEMBL5175685

C=CCOC(C)C#N

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
SCHEMBL9717906 0.80 CA1 (0.33)
SCHEMBL8555969 0.77
SCHEMBL9089562 0.76
SCHEMBL10886875 0.76
SCHEMBL28080100 0.73
SCHEMBL5507573 0.72
SCHEMBL11778064 0.71
SCHEMBL11347230 0.71
SCHEMBL16768480 0.71 TSHR (0.39)
SCHEMBL159503 0.71 LMNA (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1219597-B1 Process for production of ether amine KAO CORP (JP) 2007-02-14 EP claimed
US-6576794-B2 Reacting a primary or secondary alcohol with acrylonitrile in presence of an alkali metal hydroxide to obtain alkyloxypropionitrile, adding water without removing alkali metal hydroxide to effect hydrogenation using a catalyst KAO CORPORATION (JP) 2003-06-10 US claimed
US-20020158223-A1 Process for production of ether amine KAO CORPORATION (JP) 2002-10-31 US claimed
EP-1219597-A1 Process for production of ether amine Kao Corporation (JP) 2002-07-03 EP claimed
US-4498929-A CONTAINING A SILICONE SURFACTANT TO PREVENT PREMATURE GELATION; REACTION INJECTION MOLDING ICI AMERICAS INC. (US) 1985-02-12 US claimed
US-4477366-A INJECTION MOLDING OF POLYURETHANES OR POLYUREAS ICI AMERICAS INC. (US) 1984-10-16 US claimed
US-20140060357-A1 IMAGING MEMBER PALO ALTO RESEARCH CENTER INC. (US) 2014-03-06 US disclosed
EP-1219597-B1 Process for production of ether amine KAO CORP (JP) 2007-02-14 EP disclosed
US-6890609-B2 Ink-jet receptor sheet containing nitrile polymer AVECIA LIMITED (GB) 2005-05-10 US disclosed
US-20030176566-A1 Ink-jet receptor sheet containing nitrile polymer AVECIA INKJET LIMITED (GB) 2003-09-18 US disclosed
US-6576794-B2 Reacting a primary or secondary alcohol with acrylonitrile in presence of an alkali metal hydroxide to obtain alkyloxypropionitrile, adding water without removing alkali metal hydroxide to effect hydrogenation using a catalyst KAO CORPORATION (JP) 2003-06-10 US disclosed
US-6576794-B2 Reacting a primary or secondary alcohol with acrylonitrile in presence of an alkali metal hydroxide to obtain alkyloxypropionitrile, adding water without removing alkali metal hydroxide to effect hydrogenation using a catalyst KAO CORPORATION (JP) 2003-06-10 US disclosed
US-20020158223-A1 Process for production of ether amine KAO CORPORATION (JP) 2002-10-31 US disclosed
EP-0048984-A2 Use of organosiloxane compositions as foam stabilizers in flexible polyester polyurethane foam UNION CARBIDE CORPORATION (US) 1982-04-07 EP disclosed
US-4070500-A KETONE RESIN, EXTENDER MILLMASTER ONYX CORPORATION (US) 1978-01-24 US disclosed
US-4058494-A Polyether urethane foam produced with cyano-ether polysiloxane-polyoxyalkylene copolymers UNION CARBIDE CORPORATION (US) 1977-11-15 US disclosed
US-4046577-A PHOTOREACTIVE COMPOSITIONS COMPRISING POLYMERS CONTAINING ALKOXYAROMATIC GLYOXY GROUPS THE RICHARDSON COMPANY (US) 1977-09-06 US disclosed
US-3979420-A FLAME RETARDERS FOR POLYETHERURETHANE COPOLYMERS UNION CARBIDE CORPORATION (US) 1976-09-07 US disclosed
US-3957848-A REACTION OF POLYETHER ALCOHOL WITH ACRYLONITRILE UNION CARBIDE CORPORATION (US) 1976-05-18 US disclosed
US-3943156-A HYDROSILATION, CONDENSATION UNION CARBIDE CORPORATION (US) 1976-03-09 US disclosed