SCHEMBL677197

SCHEMBL677197

CCCCC(CCC)CN=C=O.N=C=O.N=C=O

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.32
TDP1 Q9NUW8 1/20 0.32
CYP3A4 P08684 2/20 0.31
TSHR P16473 1/20 0.31
CA2 P00918 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL28850817 1.00 ALDH1A1 (0.32) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL5481797 0.94 ALDH1A1 (0.35) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL2143137 0.92
SCHEMBL2848175 0.89
SCHEMBL7677493 0.89 LMNA (0.39)
Cyanate SCHEMBL28261530 0.86 ALDH1A1 (0.34) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL8007472 0.85 LMNA (0.31)
SCHEMBL29985526 0.84
SCHEMBL5516512 0.83 ALDH1A1 (0.33) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL28097088 0.83 ALDH1A1 (0.33) ALDH1A1TDP1CYP3A4TSHRCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024100569-A1 SUNSCREEN FORMULATION COMPRISING MICROCAPSULES, AND PROCESS FOR MANUFACTURING SUCH MICROCAPSULES COSMETIC DEVELOPMENT GROUP (FR) 2024-05-16 WO claimed
CN-113614138-B Two-component polyurethane coating with improved pot life without loss of weatherability 科思创知识产权两合公司 2024-03-29 CN claimed
US-20220403094-A1 POLYSILOXANE-FUNCTIONALIZED POLYURETHANES FOR BOOSTING THE HYDROPHOBICITY OF SURFACES COVESTRO DEUTSCHLAND AG (DE) 2022-12-22 US claimed
EP-4098678-A1 PROCESS FOR MODIFYING ISOCYANATES WITH USE OF DIFLUOROSILICATE SALTS AS CATALYST BASF SE (DE) 2022-12-07 EP claimed
CN-114829443-A Polysiloxane functionalized polyurethanes for enhancing the hydrophobicity of surfaces 科思创知识产权两合公司 2022-07-29 CN claimed
US-20220162371-A1 TWO-COMPONENT POLYURETHANE COATINGS HAVING IMPROVED POT LIFE WITHOUT A LOSS OF WEATHERING RESISTANCE COVESTRO DEUTSCHLAND AG (DE) 2022-05-26 US claimed
EP-3024863-B1 METHOD FOR MANUFACTURING POLYISOCYANATES CONTAINING IMINOOXADIAZINDIONE GROUPS AND THEIR APPLICATION COVESTRO INTELLECTUAL PROPERTY GMBH & CO KG (DE) 2022-05-04 EP claimed
EP-3985044-A1 PROCESS FOR MODIFYING ISOCYANATES BASF SE (DE) 2022-04-20 EP claimed
CN-113614138-A Two-component polyurethane coatings having improved pot life without loss of weatherability 科思创知识产权两合公司 2021-11-05 CN claimed
EP-3885385-A1 PROCESS FOR MODIFYING ISOCYANATES WITH USE OF GUANIDINIUM SALTS AS CATALYST BASF SE (DE) 2021-09-29 EP claimed
US-7329710-B2 Radiation-curable resins based on ketone-aldehyde and/or urea-aldehyde resins and a process for preparing them DEGUSSA AG (DE) 2008-02-12 US claimed
US-20070123661-A1 Utilization of radiohardenable resins based on hydrogenated ketone and phenol aldehyde resins DEGUSSA AG (DE) 2007-05-31 US claimed
EP-1508581-B1 Radiation curable resins based on ketone and/or urea-aldehyde resins and process for their preparation DEGUSSA (DE) 2007-04-04 EP claimed
US-7199166-B2 Radiation-curable resins based on hydrogenated ketone-aldehyde and phenol-aldehyde resins and a process for preparing them DEGUSSA AG (DE) 2007-04-03 US claimed
US-20070042182-A1 Encapsulated essential oils BEN GURION UNIVERSITY OF THE NEGEV RESEARCH AND DEVELOPMENT AUTHORITY (IL) 2007-02-22 US claimed
EP-1622713-A1 ENCAPSULATED ESSENTIAL OILS Ben Gurion University Of The Negev Research And Development Authority (IL) 2006-02-08 EP claimed
US-20050124716-A1 Radiation-curable resins based on hydrogenated ketone-aldehyde and phenol-aldehyde resins and a process for preparing them DEGUSSA AG (DE) 2005-06-09 US claimed
US-20050043501-A1 Radiation-curable resins based on ketone-aldehyde and/or urea-aldehyde resins and a process for preparing them DEGUSSA AG (DE) 2005-02-24 US claimed
WO-2004098767-A1 ENCAPSULATED ESSENTIAL OILS BEN GURION UNIVERSITY OF THE NEGEV RESEARCH AND DEVELOPMENT AUTHORITY (IL) 2004-11-18 WO claimed
US-6100326-A HOMOGENEOUSLY DISPERSING 4-ISOCYANATOMETHYLOCTANE 1,8-DIISOCYANATE IN WATER WITHOUT A HYDROPHILIC AGENT FOR FORMING A SOLVENT-FREE LACQUERS AND COATING AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2000-08-08 US claimed