SCHEMBL13220802

SCHEMBL13220802

C=CC(=O)OCCCCCc1ccc(-c2ccc(-c3ccc(C#N)cc3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.52
HSD17B10 Q99714 2/20 0.52
ALDH1A1 P00352 3/20 0.49
CYP3A4 P08684 1/20 0.49
HDAC1 Q13547 1/20 0.44
HDAC2 Q92769 1/20 0.44
MMP13 P45452 2/20 0.43
MMP12 P39900 1/20 0.43
THRB P10828 4/20 0.43
MMP3 P08254 2/20 0.42
MMP2 P08253 2/20 0.41
HTR1A P08908 1/20 0.40
DRD4 P21917 1/20 0.40
HTR2A P28223 1/20 0.40
HRH1 P35367 1/20 0.40
OPRM1 P35372 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
FAAH O00519 1/20 0.39
HPGD P15428 2/20 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
SCHEMBL2619036 1.00 TSHR (0.52) TSHRHSD17B10ALDH1A1CYP3A4HDAC1
SCHEMBL21389608 1.00 TSHR (0.52) TSHRHSD17B10ALDH1A1CYP3A4HDAC1
SCHEMBL29321466 1.00 TSHR (0.52) TSHRHSD17B10ALDH1A1CYP3A4HDAC1
SCHEMBL29316079 0.99 TSHR (0.50) TSHRHSD17B10ALDH1A1CYP3A4HDAC1
SCHEMBL29321446 0.95 TSHR (0.48) TSHRHSD17B10ALDH1A1CYP3A4HDAC1
SCHEMBL29316074 0.89 MMP13 (0.47) TSHRHSD17B10ALDH1A1MMP13MMP12
SCHEMBL21242530 0.89 TSHR (0.61) TSHRHSD17B10ALDH1A1CYP3A4HDAC1
SCHEMBL21242234 0.89 TSHR (0.61) TSHRHSD17B10ALDH1A1CYP3A4HDAC1
SCHEMBL13506252 0.89 TSHR (0.61) TSHRHSD17B10ALDH1A1CYP3A4HDAC1
SCHEMBL21242266 0.88 TSHR (0.59) TSHRHSD17B10ALDH1A1CYP3A4HDAC1

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-9512362-B2 Compound, liquid crystal composition, polymer material and film FUJIFILM CORPORATION (JP) 2016-12-06 US disclosed
US-9512362-B2 Compound, liquid crystal composition, polymer material and film FUJIFILM CORPORATION (JP) 2016-12-06 US disclosed
US-9481829-B2 Compound, haze-lowering agent, liquid crystal composition, polymer material, and film FUJIFILM CORPORATION (JP) 2016-11-01 US disclosed
US-9481829-B2 Compound, haze-lowering agent, liquid crystal composition, polymer material, and film FUJIFILM CORPORATION (JP) 2016-11-01 US disclosed
US-9464232-B2 Compound, liquid crystal composition, polymer material, and film FUJIFILM CORPORATION (JP) 2016-10-11 US disclosed
US-9464232-B2 Compound, liquid crystal composition, polymer material, and film FUJIFILM CORPORATION (JP) 2016-10-11 US disclosed
US-9290697-B2 Liquid crystal orientation promoter, liquid crystalline composition, macromolecular material and film FUJIFILM CORPORATION (JP) 2016-03-22 US disclosed
US-9290697-B2 Liquid crystal orientation promoter, liquid crystalline composition, macromolecular material and film FUJIFILM CORPORATION (JP) 2016-03-22 US disclosed
US-20140374657-A1 COMPOUND, LIQUID CRYSTAL COMPOSITION, POLYMER MATERIAL AND FILM FUJIFILM CORPORATION (JP) 2014-12-25 US disclosed
US-20140374657-A1 COMPOUND, LIQUID CRYSTAL COMPOSITION, POLYMER MATERIAL AND FILM FUJIFILM CORPORATION (JP) 2014-12-25 US disclosed
US-20140138580-A1 COMPOUND, HAZE-LOWERING AGENT, LIQUID CRYSTAL COMPOSITION, POLYMER MATERIAL, AND FILM FUJIFILM CORPORATION (JP) 2014-05-22 US disclosed
US-20140014877-A1 LIQUID CRYSTAL ORIENTATION PROMOTER, LIQUID CRYSTALLINE COMPOSITION, MACROMOLECULAR MATERIAL AND FILM FUJIFILM CORPORATION (JP) 2014-01-16 US disclosed
US-20140014877-A1 LIQUID CRYSTAL ORIENTATION PROMOTER, LIQUID CRYSTALLINE COMPOSITION, MACROMOLECULAR MATERIAL AND FILM FUJIFILM CORPORATION (JP) 2014-01-16 US disclosed
US-7767286-B2 Polarizing plate and liquid crystal display device FUJIFILM CORPORATION (JP) 2010-08-03 US disclosed
US-7767286-B2 Polarizing plate and liquid crystal display device FUJIFILM CORPORATION (JP) 2010-08-03 US disclosed
US-7573544-B2 Polarizing plate comprising light-scattering polarizing element and light-absorbing polarizing element FUJIFILM CORPORATION (JP) 2009-08-11 US disclosed
US-7443474-B2 Optical compensatory sheet having optically anistropic layer formed from liquid crystal molecules FUJIFILM CORPORATION (JP) 2008-10-28 US disclosed
US-7443474-B2 Optical compensatory sheet having optically anistropic layer formed from liquid crystal molecules FUJIFILM CORPORATION (JP) 2008-10-28 US disclosed
US-20080158485-A1 Polarizing plate and liquid crystal display device FUJIFILM CORPORATION (JP) 2008-07-03 US disclosed
US-20080158485-A1 Polarizing plate and liquid crystal display device FUJIFILM CORPORATION (JP) 2008-07-03 US disclosed