SCHEMBL1443601

SCHEMBL1443601

O=CCC1CCCC1=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
SCHEMBL10793844 0.93 CA1 (0.42)
Ammonia Solution, Strong SCHEMBL6100726 0.91 CA1 (0.41)
SCHEMBL30612352 0.86
SCHEMBL23781934 0.84 NPC1 (0.38)
SCHEMBL23781877 0.84 NPC1 (0.38)
SCHEMBL15423555 0.80
SCHEMBL29886436 0.80
SCHEMBL3942028 0.80
SCHEMBL2051321 0.80
SCHEMBL28283616 0.75 NPC1 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2066721-B1 PHOTOLATENT BASES FOR SYSTEMS BASED ON BLOCKED ISOCYANATES BASF SE (DE) 2017-12-27 EP claimed
CN-101522745-B Photolatent bases for systems based on blocked isocyanates CIBA HOLDING INC 2013-06-19 CN claimed
US-20090298962-A1 PHOTOLATENT BASES FOR SYSTEMS BASED ON BLOCKED ISOCYANATES BASF SE (DE) 2009-12-03 US claimed
CN-101522745-A Photolatent bases for systems based on blocked isocyanates CIBA SC HOLDING AG (CH) 2009-09-02 CN claimed
US-7553906-B2 Polyisocyanate curing agents BAYER MATERIALSCIENCE AG (DE) 2009-06-30 US claimed
EP-2066721-A1 PHOTOLATENT BASES FOR SYSTEMS BASED ON BLOCKED ISOCYANATES Ciba Holding Inc. (CH) 2009-06-10 EP claimed
WO-2008037635-A1 PHOTOLATENT BASES FOR SYSTEMS BASED ON BLOCKED ISOCYANATES CIBA HOLDING INC. (CH) 2008-04-03 WO claimed
EP-1634904-B1 Blocked polyurethane prepolymers as adhesives BAYER MATERIALSCIENCE AG (DE) 2007-06-06 EP claimed
US-7220814-B2 Hydrophilicized blocked polyisocyanates BAYER MATERIALSCIENCE AG (DE) 2007-05-22 US claimed
US-7148374-B2 Elimination-free powder coating crosslinking agents BAYER AKTIENGESELLSCHAFT (DE) 2006-12-12 US claimed
US-6827875-B2 For production of polyisocyanates for use in forming one-component polyurethane stoving lacquer; automobile primer surfacers BAYER AKTIENGESELLSCHAFT (DE) 2004-12-07 US claimed
US-20040147704-A1 Reactive systems, their preparation and their use COVESTRO DEUTSCHLAND AG (DE) 2004-07-29 US claimed
US-20040138403-A1 Hydrophilicized blocked polyisocyanates BAYER AKTIENGESELLSCHAFT (DE) 2004-07-15 US claimed
US-20040133035-A1 Elimination-free powder coating crosslinking agents BAYER AKTIENGESELLSCHAFT (DE) 2004-07-08 US claimed
US-20040132909-A1 Dual cure systems ALLNEX NETHERLANDS B.V. (NL) 2004-07-08 US claimed
EP-1404737-A1 CYCLIC KETONES AS BLOCKING AGENTS Bayer MaterialScience AG (DE) 2004-04-07 EP claimed
US-20040030086-A1 Blocked polyisocyanates COVESTRO DEUTSCHLAND AG (DE) 2004-02-12 US claimed
EP-1375548-A1 Blocked polyisocyanates Bayer Aktiengesellschaft (DE) 2004-01-02 EP claimed
US-20030026999-A1 Cyclic ketones as blocking agents BAYER AKTIENGESELLSCHAFT (DE) 2003-02-06 US claimed
WO-2003004545-A1 CYCLIC KETONES AS BLOCKING AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2003-01-16 WO claimed