SCHEMBL3105371

SCHEMBL3105371

C=CCC=C(C)C(=O)OCCCCCCOC(=O)C(C)=CC

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.42
ALDH1A1 P00352 1/20 0.40
CYP3A4 P08684 1/20 0.40
HTT P42858 2/20 0.36
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HPGD P15428 1/20 0.33
NAAA Q02083 1/20 0.31
HCAR2 Q8TDS4 1/20 0.30
RAD52 P43351 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL6909255 0.91 THRB (0.35) TSHRALDH1A1
SCHEMBL9709320 0.89 TSHR (0.57) TSHRALDH1A1CYP3A4HTTHPGD
SCHEMBL10761848 0.89 TSHR (0.57) TSHRALDH1A1CYP3A4HTTHPGD
SCHEMBL325190 0.87 TSHR (0.54) TSHRALDH1A1CYP3A4HTTHPGD
SCHEMBL8971295 0.85 TSHR (0.50) TSHRALDH1A1CYP3A4TDP1HPGD
SCHEMBL32686846 0.84 TSHR (0.50) TSHRALDH1A1CYP3A4HTTPOLB
SCHEMBL10456655 0.82 TSHR (0.47) TSHRALDH1A1CYP3A4HTTPOLB
SCHEMBL3748655 0.82 TSHR (0.47) TSHRALDH1A1CYP3A4HTTPOLB
SCHEMBL7758552 0.81 TSHR (0.44) TSHR
SCHEMBL10764193 0.81 TSHR (0.38) TSHRALDH1A1POLBTDP1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210128294-A1 Optical Material and Method for Modifying the Refractive Index UNIV ROCHESTER (US) 2021-05-06 US disclosed
US-10893936-B2 Optical device and method for modifying the refractive index of an optical material UNIVERSITY OF ROCHESTER (US) 2021-01-19 US disclosed
US-10543076-B2 Optical material and method for modifying the refractive index UNIVERSITY OF ROCHESTER (US) 2020-01-28 US disclosed
US-20190240002-A1 OPTICAL DEVICE AND METHOD FOR MODIFYING THE REFRACTIVE INDEX OF AN OPTICAL MATERIAL UNIV ROCHESTER (US) 2019-08-08 US disclosed
US-10299909-B2 Optical device and method for modifying the refractive index of an optical material UNIVERSITY OF ROCHESTER (US) 2019-05-28 US disclosed
US-20170181846-A1 Optical Material and Method for Modifying the Refractive Index UNIV ROCHESTER (US) 2017-06-29 US disclosed
US-9622912-B2 Method for modifying the refractive index of an optical material UNIVERSITY OF ROCHESTER (US) 2017-04-18 US disclosed
US-20150126979-A1 Method for Modifying the Refractive Index of an Optical Material UNIVERSITY OF ROCHESTER 2015-05-07 US disclosed
US-8932352-B2 Optical material and method for modifying the refractive index UNIVERSITY OF ROCHESTER (US) 2015-01-13 US disclosed
US-20130178934-A1 Optical Material and Method for Modifying the Refractive Index UNIVERSITY OF ROCHESTER 2013-07-11 US disclosed
US-7789910-B2 Optical material and method for modifying the refractive index BAUSCH & LOMB INCORPORATED (US) 2010-09-07 US disclosed
EP-2032102-B1 OPTICAL MATERIAL AND METHOD FOR MODIFYING THE REFRACTIVE INDEX BAUSCH & LOMB (US) 2010-07-28 EP disclosed
US-20090143858-A1 OPTICAL MATERIAL AND METHOD FOR MODIFYING THE REFRACTIVE INDEX SOLTA MEDICAL DUTCH HOLDINGS B.V. (NL) 2009-06-04 US disclosed
EP-2032102-A2 OPTICAL MATERIAL AND METHOD FOR MODIFYING THE REFRACTIVE INDEX Bausch & Lomb Incorporated (US) 2009-03-11 EP disclosed
US-20080001320-A1 Optical Material and Method for Modifying the Refractive Index SOLTA MEDICAL IRELAND LIMITED (IE) 2008-01-03 US disclosed
WO-2008002796-A2 OPTICAL MATERIAL AND METHOD FOR MODIFYING THE REFRACTIVE INDEX BAUSCH & LOMB INCORPORATED (US) 2008-01-03 WO disclosed
US-6852820-B2 Method for preparing acrylic copolymer materials suitable for ophthalmic devices NIDEK CO., LTD. (JP) 2005-02-08 US disclosed
US-20020151667-A1 Method for preparing acrylic copolymer materials suitable for ophthalmic devices NIDEK CO., LTD. 2002-10-17 US disclosed
EP-1035142-A1 Acrylic copolymer materials suitable for ophthalmic devices Nidek Co., Ltd. (JP) 2000-09-13 EP disclosed
US-5290892-A Crosslinked phenylethyl acrylate-phenylethyl methacrylate NESTLE S.A. (CH) 1994-03-01 US disclosed