SCHEMBL429546

SCHEMBL429546

CN(C)CCCC(O)CN

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
TSHR P16473 1/20 0.39
HTR2A P28223 1/20 0.38
HRH1 P35367 1/20 0.38
TDP1 Q9NUW8 2/20 0.37
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
HRH4 Q9H3N8 2/20 0.34
CYP1A2 P05177 1/20 0.34
HRH2 P25021 1/20 0.34
DNM1 Q05193 3/20 0.33
HSD17B10 Q99714 1/20 0.33
GABRR1 P24046 2/20 0.32
GABBR2 O75899 1/20 0.32
GABBR1 Q9UBS5 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 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
SCHEMBL11328205 0.93 ALDH1A1 (0.43) ALDH1A1TSHRHTR2AHRH1TDP1
SCHEMBL10542936 0.85
SCHEMBL6407485 0.85
SCHEMBL2454527 0.85 ALDH1A1 (0.47) ALDH1A1TSHRHTR2AHRH1TDP1
SCHEMBL28959405 0.85 TDP1 (0.42) ALDH1A1TSHRHTR2AHRH1TDP1
SCHEMBL9671940 0.82 ALDH1A1 (0.45) ALDH1A1TSHRHTR2AHRH1TDP1
SCHEMBL10937125 0.79 CA12 (0.40) ALDH1A1TSHRTDP1CYP2C9CYP2C19
SCHEMBL2323251 0.79 ALDH1A1 (0.38) ALDH1A1TSHRHTR2AHRH1TDP1
SCHEMBL23394580 0.78 ALDH1A1 (0.41) ALDH1A1TSHRHTR2AHRH1TDP1
SCHEMBL1132685 0.78 THRB (0.43) ALDH1A1TSHRHTR2AHRH1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4662256-A1 A TRANSPARENT PUD AND ITS APPLICATION Covestro Deutschland AG (DE) 2025-12-17 EP disclosed
US-12466978-B2 Nanocellulose-containing aqueous coating composition for automotive exterior KANSAI PAINT CO., LTD. (JP) 2025-11-11 US disclosed
US-12435177-B2 Aqueous polyurethane resin composition and coating material using the composition COVESTRO DEUTSCHLAND AG (DE) 2025-10-07 US disclosed
EP-4435029-A1 A TRANSPARENT PUD AND ITS APPLICATION Covestro Deutschland AG (DE) 2024-09-25 EP disclosed
WO-2024165520-A1 A TRANSPARENT PUD AND ITS APPLICATION COVESTRO DEUTSCHLAND AG (DE) 2024-08-15 WO disclosed
WO-2024164160-A1 A TRANSPARENT PUD AND ITS APPLICATION COVESTRO DEUTSCHLAND AG (DE) 2024-08-15 WO disclosed
US-20240240049-A1 AQUEOUS COATING COMPOSITION FOR AUTOMOTIVE EXTERIOR KANSAI PAINT CO., LTD. (JP) 2024-07-18 US disclosed
EP-4353790-A1 AQUEOUS COATING COMPOSITION FOR AUTOMOTIVE EXTERIOR Kansai Paint Co., Ltd (JP) 2024-04-17 EP disclosed
CN-117255838-A Water-based paint composition for automobile exterior trim 关西涂料株式会社 2023-12-19 CN disclosed
CN-112955261-B Method for forming multilayer coating film 日涂汽车涂料有限公司 2023-05-30 CN disclosed
EP-1865010-A1 WATER DISPERSIBLE POLYURETHANE COMPOSITION Adeka Corporation (JP) 2007-12-12 EP disclosed
CN-101067024-A Method for preparing organic silicon compound with beta-keto carbonyl group function WAKE CHEMIE INC (DE) 2007-11-07 CN disclosed
US-20060121204-A1 Water-based intercoating composition and method of forming multilayered coating film NIPPON PAINT CO., INC. (JP) 2006-06-08 US disclosed
CN-1615376-A Surface-treated metal sheet and surface-treating agent JFE STEEL CORP (JP) 2005-05-11 CN disclosed
US-20040185261-A1 Surface-treated metal sheet and surface-treating agent JFE STEEL CORPORATION, A CORPORATION OF JAPAN (JP) 2004-09-23 US disclosed
EP-1445349-A1 SURFACE−TREATED METAL SHEET AND SURFACE−TREATING AGENT JFE Steel Corporation (JP) 2004-08-11 EP disclosed
EP-0523189-A1 CATIONIC LIPIDS FOR INTRACELLULAR DELIVERY OF BIOLOGICALLY ACTIVE MOLECULES VICAL, INC. (US) 1993-01-20 EP disclosed
US-5096982-A Rubber-based molding materials HOECHST AKTIENGESELLSCHAFT (DE) 1992-03-17 US disclosed
WO-1991016024-A1 CATIONIC LIPIDS FOR INTRACELLULAR DELIVERY OF BIOLOGICALLY ACTIVE MOLECULES VICAL, INC. (US) 1991-10-31 WO disclosed
US-4251637-A TO PREPARE A POLYMER CONTAINING RECURRING ISOCYANURATE AND URETHANE LINKAGES TEXACO DEVELOPMENT CORPORATION (US) 1981-02-17 US disclosed