SCHEMBL6851905

SCHEMBL6851905

CCCCC(C(=O)O)=C(C)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.56
CES1 P23141 4/20 0.56
PTGS2 P35354 2/20 0.49
ALDH1A1 P00352 1/20 0.46
THRB P10828 1/20 0.46
FNTA P49354 1/20 0.46
FNTB P49356 1/20 0.46
PGGT1B P53609 1/20 0.46
NAAA Q02083 1/20 0.44
ESR1 P03372 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
LMNA P02545 2/20 0.41
MAPT P10636 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
GAA P10253 1/20 0.41
HSD17B3 P37058 1/20 0.41
KDM4E B2RXH2 1/20 0.41
RECQL P46063 1/20 0.41

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
SCHEMBL22096935 1.00 CES2 (0.56) CES2CES1PTGS2ALDH1A1THRB
SCHEMBL9815578 0.95 CES2 (0.57) CES2CES1PTGS2THRBFNTA
SCHEMBL23934249 0.86 ALDH1A1 (0.44) CES2CES1ALDH1A1THRBFNTA
SCHEMBL28552433 0.86 PTGS2 (0.62) CES2CES1PTGS2ALDH1A1NAAA
SCHEMBL23934177 0.85 ALDH1A1 (0.47) CES2CES1ALDH1A1THRBFNTA
SCHEMBL3142137 0.84 CES2 (0.57) CES2CES1PTGS2THRBFNTA
SCHEMBL3142142 0.84 CES2 (0.57) CES2CES1PTGS2THRBFNTA
SCHEMBL3142146 0.84 CES2 (0.57) CES2CES1PTGS2THRBFNTA
SCHEMBL22097002 0.83 HDAC1 (0.50) CES2CES1ALDH1A1LMNAMEN1
SCHEMBL23934179 0.82 RAB9A (0.47) L3MBTL1MAPTTDP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104109538-B Aligning agent for liquid crystal, liquid crystal orientation film, liquid crystal display cells, phase retardation film and its manufacture method, polymer and compound JSR株式会社 2018-01-16 CN disclosed
CN-103571501-B Liquid crystal aligning agent, liquid crystal alignment film, liquid crystal display device, and manufacturing method for the liquid crystal alignment film JSR株式会社 2017-05-24 CN disclosed
CN-103450479-B Crystal aligning agent, liquid crystal orienting film and liquid crystal display cells JSR CO., LTD. (JP) 2016-11-30 CN disclosed
CN-105602580-A Liquid crystal aligning agent, liquid crystal alignment film and liquid crystal display element CHI MEI CORP 2016-05-25 CN disclosed
US-20040067001-A1 Ultra-thin polarization mode converters based on liquid crystal materials INTEL CORPORATION 2004-04-08 US disclosed
US-4941992-A FERROELECTRIC OPTICAL APPARATUS THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 1990-07-17 US disclosed
EP-0241502-B1 N-SUBSTITUTED AMINO ACID DERIVATIVES FOR USE IN LIQUID CRYSTAL MATERIALS AND DEVICES The Secretary of State for Defence in Her Britannic Majesty's Government of the United Kingdom of Great Britain and (GB) 1990-05-23 EP disclosed
EP-0156726-B1 PROCESS FOR THE PREPARATION OF A SMECTIC C-CHIRAL FERROELECTRIC LIQUID CRYSTAL, LIQUID CRYSTAL AND DISPLAY DEVICE USING THE SAME. THOMSON-CSF (FR) 1988-01-13 EP disclosed
EP-0241502-A1 N-SUBSTITUTED AMINO ACID DERIVATIVES FOR USE IN LIQUID CRYSTAL MATERIALS AND DEVICES. SECR DEFENCE BRIT (GB) 1987-10-21 EP disclosed
WO-1987002375-A1 N-SUBSTITUTED AMINO ACID DERIVATIVES FOR USE IN LIQUID CRYSTAL MATERIALS AND DEVICES THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNI (GB) 1987-04-23 WO disclosed
EP-0156726-A1 Process for the preparation of a smectic C-chiral ferroelectric liquid crystal, liquid crystal and display device using the same. THOMSON-CSF (FR) 1985-10-02 EP disclosed