SCHEMBL263105

SCHEMBL263105

C=C(C)C(=O)OCC(NC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 7/20 0.47
PPARG P37231 6/20 0.45
TSHR P16473 1/20 0.45
CTSS P25774 6/20 0.43
CTSK P43235 6/20 0.43
IDO1 P14902 1/20 0.41
CTSL P07711 1/20 0.41
CTSB P07858 1/20 0.41
ACE P12821 1/20 0.41
PPARD Q03181 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
HTT P42858 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
ITGB3 P05106 1/20 0.39
ITGA2B P08514 1/20 0.39

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
SCHEMBL29915584 1.00 PPARA (0.47) PPARAPPARGTSHRCTSSCTSK
SCHEMBL29915508 0.91 TSHR (0.47) PPARATSHRCTSSCTSKCTSL
SCHEMBL4835696 0.88 PPARA (0.49) PPARAPPARGCTSSCTSKIDO1
SCHEMBL1100322 0.84 PPARA (0.51) PPARAPPARGCTSSCTSKIDO1
SCHEMBL1088542 0.84 PPARA (0.51) PPARAPPARGCTSSCTSKIDO1
SCHEMBL27976175 0.82 CTSK (0.43) PPARAPPARGTSHRCTSSCTSK
SCHEMBL27852438 0.80 CYP1A2 (0.40) PPARAPPARGCTSSCTSKIDO1
SCHEMBL22468774 0.80 PPARA (0.50) PPARAPPARGCTSSCTSKIDO1
SCHEMBL22468776 0.80 PPARA (0.50) PPARAPPARGCTSSCTSKIDO1
SCHEMBL4836818 0.79 PPARA (0.56) PPARAPPARGCTSSCTSKIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2443485-B1 BIOMEDICAL DEVICES BAUSCH & LOMB (US) 2017-11-08 EP disclosed
EP-2443486-B1 BIOMEDICAL DEVICES BAUSCH & LOMB (US) 2017-03-01 EP disclosed
EP-2443482-B1 BIOMEDICAL DEVICES, POLYMERIC MATERIALS AND CONTACT LENSES COMPRISING THE SAME. BAUSCH & LOMB (US) 2017-03-01 EP disclosed
EP-2443483-B1 MULTI-ARMED MACROMONOMERS, POLYMERIC MATERIALS AND CONTACT LENSES COMPRISING SAME. BAUSCH & LOMB (US) 2016-03-23 EP disclosed
US-9285508-B2 Biomedical devices BAUSCH & LOMB INCORPORATED (US) 2016-03-15 US disclosed
EP-2443485-A2 BIOMEDICAL DEVICES Bausch & Lomb Incorporated (US) 2012-04-25 EP disclosed
EP-2443482-A2 BIOMEDICAL DEVICES Bausch & Lomb Incorporated (US) 2012-04-25 EP disclosed
EP-2443483-A1 MULTI-ARMED MACROMONOMERS, POLYMERIC MATERIALS AND CONTACT LENSES COMPRISING SAME Bausch & Lomb Incorporated (US) 2012-04-25 EP disclosed
EP-2443486-A2 BIOMEDICAL DEVICES Bausch & Lomb Incorporated (US) 2012-04-25 EP disclosed
US-8133960-B2 Biomedical devices BAUSCH & LOMB INCORPORATED (US) 2012-03-13 US disclosed
US-8083348-B2 Biomedical devices BAUSCH & LOMB INCORPORATED (US) 2011-12-27 US disclosed
WO-2010147875-A2 BIOMEDICAL DEVICES BAUSCH & LOMB INCORPORATED (US) 2010-12-23 WO disclosed
WO-2010147865-A1 MULTI-ARMED MACROMONOMERS, POLYMERIC MATERIALS AND CONTACT LENSES COMPRISING SAME BAUSCH & LOMB INCORPORATED (US) 2010-12-23 WO disclosed
WO-2010147864-A2 BIOMEDICAL DEVICES BAUSCH & LOMB INCORPORATED (US) 2010-12-23 WO disclosed
WO-2010147876-A2 BIOMEDICAL DEVICES BAUSCH & LOMB INCORPORATED (US) 2010-12-23 WO disclosed
US-20100317816-A1 Biomedical devices BAUSCH & LOMB INCORPORATED (US) 2010-12-16 US disclosed
US-20100318185-A1 Biomedical Devices BAUSCH & LOMB INCORPORATED (US) 2010-12-16 US disclosed
US-20100317817-A1 Biomedical devices BAUSCH & LOMB INCORPORATED (US) 2010-12-16 US disclosed
US-20100315588-A1 Biomedical devices BAUSCH & LOMB INCORPORATED (US) 2010-12-16 US disclosed