SCHEMBL181998

SCHEMBL181998

C=C(C)C(=O)OCCOC(=O)NCCC(C)CC(C)(C)CNC(=O)OCCOC(=O)C(=C)C

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.37
TSHR P16473 3/20 0.36
HRH4 Q9H3N8 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
ACHE P22303 10/20 0.35
CHRNB2 P17787 4/20 0.35
CHRNB4 P30926 4/20 0.35
CHRNA3 P32297 4/20 0.35
CHRNA4 P43681 4/20 0.35

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
SCHEMBL4094910 0.96 TSHR (0.43) THRBTSHRHRH4HRH3ACHE
SCHEMBL17075532 0.96 THRB (0.40) THRBTSHRHRH4HRH3ACHE
SCHEMBL21547311 0.96 THRB (0.35) THRBTSHRHRH4HRH3ACHE
SCHEMBL18558149 0.96 THRB (0.35) THRBTSHRHRH4HRH3ACHE
SCHEMBL28572695 0.96 THRB (0.40) THRBTSHRHRH4HRH3ACHE
SCHEMBL10405560 0.95 ACHE (0.38) THRBTSHRHRH4HRH3ACHE
SCHEMBL472550 0.95 ACHE (0.38) THRBTSHRHRH4HRH3ACHE
SCHEMBL22663545 0.95 THRB (0.34) THRBTSHRHRH4HRH3ACHE
SCHEMBL20460074 0.95 THRB (0.34) THRBTSHRHRH4HRH3ACHE
SCHEMBL3132587 0.95 ACHE (0.38) THRBTSHRHRH4HRH3ACHE

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

Appears in 2794 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12636181-B2 Adjustable thermoplastic dental appliance system and method FRANTZ DESIGN INCORPORATED (US) 2026-05-26 US claimed
WO-2026107382-A1 DENTAL DEVICE FOR POSITIONING OF A MATERIAL LOMA LINDA UNIVERSITY HEALTH (US) 2026-05-21 WO claimed
US-20260132235-A1 2-Component Dental Materials Based On Crosslinked Polymeric Particles Bearing Acylthiourea Groups IVOCLAR VIVADENT AG (LI) 2026-05-14 US claimed
US-20260124121-A1 POLYMERIZABLE DENTAL COMPOSITION TROETSCHLER TOBIAS (DE) 2026-05-07 US claimed
EP-4736833-A1 POLYMERIZABLE DENTAL COMPOSITION DENTSPLY SIRONA Inc. (US) 2026-05-06 EP claimed
US-20260115107-A1 FUNCTIONALIZED ANTI-MICROBIAL PARTICLES NOBIO LTD. (IL) 2026-04-30 US claimed
US-20260108431-A1 BIOACTIVE COMPOSITES FOR BONE VOID FILLER COMPOSITIONS AND METHODS ORTHOMOD LLC (US) 2026-04-23 US claimed
EP-4729042-A1 A DENTAL RESTORATIVE COMPOSITION Stick Tech OY (FI) 2026-04-22 EP claimed
US-20260102319-A1 PHOTORESPONSIVE AZOBENZENE FUNCTIONAL NANOGELS AND THEIR USE IN DENTAL ADHESIVES UNIV COLORADO REGENTS (US) 2026-04-16 US claimed
EP-4721699-A1 COMPOSITE BULK BLOCK FOR MANUFACTURING PROSTHESIS, MANUFACTURING METHOD THEREFOR, AND PROSTHESIS MANUFACTURED THEREFROM Hass Co., Ltd. (KR) 2026-04-08 EP claimed
EP-1294304-A1 DENTAL PROSTHESIS AND PROCESS FOR THE MAKING THEREOF Cicero Dental Systems B.V. (NL) 2003-03-26 EP claimed
US-20020082315-A1 URETHANE DI(METH)ACRYLATE DERIVATIVES OF 1,3-BIS(1-ISOCYANATO-1-METHYLETHYL)BENZENE IVOCLAR AG (LI) 2002-06-27 US claimed
US-6353039-B1 CROSSLINKING POLYMER COMPOSITES AND TRANSPARENT GLASS IVOCLAR AG (LI) 2002-03-05 US claimed
WO-2002000135-A1 DENTAL PROSTHESIS AND PROCESS FOR THE MAKING THEREOF CICERO DENTAL SYSTEMS B.V. (NL) 2002-01-03 WO claimed
US-6180688-B1 DENTAL MATERIALS WHICH ARE CAPABLE OF RELEASING IONS, IN THE ORAL CAVITY CONSISTS OF A NONACID, NONIONIC UNSATURATED HYDRPHILLIC CROSSLINKER, NONACID, NONIONIC HYDROPHILLIC DILUTION MONOMER, AND AN ION RELEASING FILLER IVOCLAR AG (LI) 2001-01-30 US claimed
EP-0934926-A1 Urethane di(meth)acrylate derivatives of 1,3-bis(1-isocyanato-1-methylethyl)benzene IVOCLAR AG (LI) 1999-08-11 EP claimed
EP-0923926-A2 Ion leachable composite material IVOCLAR AG (LI) 1999-06-23 EP claimed
EP-0923925-A2 Polymerisable composite material IVOCLAR AG (LI) 1999-06-23 EP claimed
EP-0176777-B1 LIGHT CURABLE DENTAL COMPOSITION NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-11-23 EP claimed
US-4704303-A PHOTOPOLYMERIZATION CREATIVE NAIL DESIGN, A CORP. OF CA 1987-11-03 US claimed