SCHEMBL3826644

SCHEMBL3826644

CCC1(N=C=O)CCCCC1

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
SCHEMBL11056868 0.98
SCHEMBL11052365 0.83
SCHEMBL1160110 0.81
SCHEMBL28002 0.81
SCHEMBL11042954 0.79 CETP (0.31)
SCHEMBL11264766 0.77
SCHEMBL6819474 0.77
SCHEMBL1479371 0.77
SCHEMBL48237 0.77 ALDH1A1 (0.30)
SCHEMBL15262017 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101343440-B Dispersion liquid of modified metal oxide or silica particle, coating composition, and coating film DEUCHEM CO LTD 2011-06-29 CN claimed
CN-101343440-A Modified metal oxide particle dispersion liquid, coating composition, and coating film DEUCHEM CO LTD (CN) 2009-01-14 CN claimed
CN-103946255-A Polyoxymethylene compositions for producing containment devices TICONA LLC 2014-07-23 CN disclosed
CN-102414235-B Castable polyurea compositions for golf ball covers DOW GLOBAL TECHNOLOGIES INC 2013-09-04 CN disclosed
CN-103228692-A Coupled Glass Fiber Reinforced Polyoxymethylene TICONA GMBH 2013-07-31 CN disclosed
CN-103228727-A VOC or compressed gas containment device made from polyoxymethylene polymer TICONA LLC 2013-07-31 CN disclosed
CN-103228728-A Plasticized polyoxymethylene TICONA GMBH 2013-07-31 CN disclosed
CN-102731959-A High impact resistant polyoxymethylene for extrusion blow molding TICONA GMBH 2012-10-17 CN disclosed
CN-102558755-A Glass fiber reinforced polyoxymethylene TICONA GMBH 2012-07-11 CN disclosed
CN-102414235-A Castable polyurea compositions for golf ball covers DOW GLOBAL TECHNOLOGIES INC 2012-04-11 CN disclosed
CN-101343440-B Dispersion liquid of modified metal oxide or silica particle, coating composition, and coating film DEUCHEM CO LTD 2011-06-29 CN disclosed
US-20080096693-A1 Multi-Layer Golf Ball having Velocity Gradient from Slower Center to Faster Cover ACUSHNET COMPANY 2008-04-24 US disclosed
WO-2006094850-A1 AQUEOUS COATING SUBSTANCE COMPOSITIONS HAVING AN IMPROVED RESISTANCE TO STONING DEGUSSA GMBH (DE) 2006-09-14 WO disclosed
EP-0574413-B1 AQUEOUS TEXTILE AUXILIARY COMPOSITION CIBA GEIGY AG (CH) 1996-06-05 EP disclosed
EP-0601079-A1 THERMOSETTING POWDER COATING COMPOSITIONS EASTMAN CHEMICAL COMPANY (US) 1994-06-15 EP disclosed
WO-1993004102-A1 THERMOSETTING POWDER COATING COMPOSITIONS EASTMAN KODAK COMPANY (US) 1993-03-04 WO disclosed
CN-1047871-A POLYISOCYANURATE FOAM WALTER JIM RES CORP (US) 1990-12-19 CN disclosed
EP-0025907-B1 HALOGENATED TERTIARY ALKYL ISOCYANATES AND PROCESS FOR THEIR PREPARATION BASF Aktiengesellschaft (DE) 1984-06-20 EP disclosed
US-4344891-A Halogenated tertiary alkyl isocyanates and their preparation BASF AKTIENGESELLSCHAFT (DE) 1982-08-17 US disclosed
EP-0025907-A1 Halogenated tertiary alkyl isocyanates and process for their preparation BASF Aktiengesellschaft (DE) 1981-04-01 EP disclosed