SCHEMBL2278628

SCHEMBL2278628

C=CCCCNC=O

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
SCHEMBL2285935 0.95
SCHEMBL2288282 0.92 ADH1B (0.52)
SCHEMBL2283532 0.92 ADH1B (0.52)
SCHEMBL2282753 0.92 ADH1B (0.52)
SCHEMBL2285298 0.92 ADH1B (0.52)
SCHEMBL2285775 0.92 ADH1B (0.52)
SCHEMBL2281691 0.92 ADH1B (0.52)
SCHEMBL1766882 0.83
SCHEMBL292359 0.80
SCHEMBL8068062 0.80 ADH1B (0.71)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7994273-B2 Photoactive materials ROLIC AG (CH) 2011-08-09 US claimed
US-7750185-B2 Photoactive materials ROLIC AG (CH) 2010-07-06 US claimed
US-20050288480-A1 Liquid crystals adjustment layers containing diamine compound; polyamic acid or polyimides; crosslinked ROLIC AG (CH) 2005-12-29 US claimed
EP-1525182-A1 PHOTOACTIVE MATERIALS Rolic AG (CH) 2005-04-27 EP claimed
WO-2004013086-A1 PHOTOACTIVE MATERIALS ROLIC AG (CH) 2004-02-12 WO claimed
EP-1386910-A1 Photoactive materials Rolic AG (CH) 2004-02-04 EP claimed
US-8436132-B2 Photoactive materials ROLIC AG (CH) 2013-05-07 US disclosed
US-20110236602-A1 PHOTOACTIVE MATERIALS ROLIC AG (CH) 2011-09-29 US disclosed
US-7994273-B2 Photoactive materials ROLIC AG (CH) 2011-08-09 US disclosed
US-20100272979-A1 PHOTOACTIVE MATERIALS ROLIC AG (CH) 2010-10-28 US disclosed
US-7750185-B2 Photoactive materials ROLIC AG (CH) 2010-07-06 US disclosed
US-20050288480-A1 Liquid crystals adjustment layers containing diamine compound; polyamic acid or polyimides; crosslinked ROLIC AG (CH) 2005-12-29 US disclosed
EP-1386910-A1 Photoactive materials Rolic AG (CH) 2004-02-04 EP disclosed
US-5025033-A Alkylene diamines TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-06-18 US disclosed
EP-0412699-A2 Nitrosothiol derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1991-02-13 EP disclosed
EP-0330026-A1 Piperidinoalkyl derivatives of carboxylic acid amides Takeda Chemical Industries, Ltd. (JP) 1989-08-30 EP disclosed
EP-0326106-A2 Alkylene diamines Takeda Chemical Industries, Ltd. (JP) 1989-08-02 EP disclosed
US-4810567-A WITH FUNCTIONAL VINYL MONOMERS, REACTION WITH ANTIMICROBIAL AGENT; OR FABRIC-UNSATURATED ANTIMICROBIAL REACTION UOP (US) 1989-03-07 US disclosed
US-4804665-A NERVOUS SYSTEM DISORDERS; COGNITION ACTIVATORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1989-02-14 US disclosed
EP-0273659-A1 Azaspiro compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1988-07-06 EP disclosed