SCHEMBL4345289

SCHEMBL4345289

C=C(C)C(=O)OC1(CCCC)CCCCC1O

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
NAAA Q02083 2/20 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
SCHEMBL9244832 0.96 TSHR (0.36) TSHR
SCHEMBL3809855 0.87
SCHEMBL4400972 0.84 TSHR (0.34) TSHR
SCHEMBL4399265 0.83 TSHR (0.33) TSHR
SCHEMBL3659982 0.83
SCHEMBL4400976 0.82 TSHR (0.36) TSHR
SCHEMBL10083140 0.81 ALDH1A1 (0.34) TSHR
SCHEMBL13262547 0.81 TSHR (0.37) TSHRNAAA
SCHEMBL4406138 0.76 ALDH1A1 (0.30)
SCHEMBL4401688 0.75 TSHR (0.42) TSHR

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0672074-A1 POLYMER COMPOSITIONS FOR CONTACT LENSES. BAUSCH & LOMB (US) 1995-09-20 EP claimed
WO-1994012550-A1 POLYMER COMPOSITIONS FOR CONTACT LENSES BAUSCH & LOMB INCORPORATED (US) 1994-06-09 WO claimed
WO-2009070438-A1 OPTICAL MATERIAL AND METHOD FOR MODIFYING THE REFRACTIVE INDEX BAUSCH & LOMB INCORPORATED (US) 2009-06-04 WO disclosed
EP-2038328-A2 CARBOXYLIC M2DX-LIKE SILOXANYL MONOMERS Bausch & Lomb Incorporated (US) 2009-03-25 EP disclosed
WO-2007082113-A9 SILOXANE PREPOLYMER CONTAINING PENDANT CATIONIC AND POLYMERIZABLE GROUPS BAUSCH & LOMB (US) 2008-10-09 WO disclosed
EP-1969035-A2 SILOXANE PREPOLYMER CONTAINING PENDANT AND END-CAPPING CATIONIC AND POLYMERIZABLE GROUPS Bausch & Lomb Incorporated (US) 2008-09-17 EP disclosed
WO-2008039654-A2 WATER SOLUBLE SILICONE MACROMONOMERS FOR OPHTHALMIC MATERIALS BAUSCH & LOMB INCORPORATED (US) 2008-04-03 WO disclosed
WO-2008005645-A2 CARBOXYLIC M2DX-LIKE SILOXANYL MONOMERS BAUSCH & LOMB INCORPORATED (US) 2008-01-10 WO disclosed
EP-1828813-A1 POLYMERIZABLE SURFACTANTS AND THEIR USE AS DEVICE FORMING COMONOMERS Bausch & Lomb Incorporated (US) 2007-09-05 EP disclosed
WO-2007082119-A2 SILOXANE PREPOLYMER CONTAINING PENDANT AND END-CAPPING CATIONIC AND POLYMERIZABLE GROUPS BAUSCH & LOMB INCORPORATED (US) 2007-07-19 WO disclosed
WO-2006068705-A1 POLYMERIZABLE SURFACTANTS AND THEIR USE AS DEVICE FORMING COMONOMERS BAUSCH & LOMB INCORPORATED (US) 2006-06-29 WO disclosed
EP-0672074-A1 POLYMER COMPOSITIONS FOR CONTACT LENSES. BAUSCH & LOMB (US) 1995-09-20 EP disclosed
WO-1994012550-A1 POLYMER COMPOSITIONS FOR CONTACT LENSES BAUSCH & LOMB INCORPORATED (US) 1994-06-09 WO disclosed