SCHEMBL1894341

SCHEMBL1894341

CCCCCCCCCCc1ccc(-c2ccc(C#N)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 1.00
TSHR P16473 1/20 1.00
RARB P10826 5/20 0.54
ALDH1A1 P00352 3/20 0.54
MEN1 O00255 2/20 0.54
MAPT P10636 2/20 0.54
KMT2A Q03164 2/20 0.54
RARA P10276 1/20 0.54
MTOR P42345 1/20 0.54
CYP19A1 P11511 3/20 0.52
CYP2A6 P11509 1/20 0.52
ESR1 P03372 2/20 0.52
ADRA2A P08913 2/20 0.52
ADORA3 P0DMS8 2/20 0.52
TACR2 P21452 2/20 0.52
SLC6A2 P23975 2/20 0.52
SLC6A4 P31645 2/20 0.52
SLC6A3 Q01959 2/20 0.52
KDM4E B2RXH2 2/20 0.52
LMNA P02545 1/20 0.52

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
SCHEMBL508486 1.00 HSD17B10 (1.00) HSD17B10TSHRRARBALDH1A1MEN1
SCHEMBL8022050 1.00 HSD17B10 (1.00) HSD17B10TSHRRARBALDH1A1MEN1
SCHEMBL1896035 1.00 HSD17B10 (1.00) HSD17B10TSHRRARBALDH1A1MEN1
SCHEMBL25181545 1.00 HSD17B10 (1.00) HSD17B10TSHRRARBALDH1A1MEN1
SCHEMBL1325933 1.00 HSD17B10 (1.00) HSD17B10TSHRRARBALDH1A1MEN1
SCHEMBL25190474 1.00 HSD17B10 (1.00) HSD17B10TSHRRARBALDH1A1MEN1
SCHEMBL20700 1.00 HSD17B10 (1.00) HSD17B10TSHRRARBALDH1A1MEN1
SCHEMBL25187484 1.00 HSD17B10 (1.00) HSD17B10TSHRRARBALDH1A1MEN1
SCHEMBL1890052 1.00 HSD17B10 (1.00) HSD17B10TSHRRARBALDH1A1MEN1
SCHEMBL10456882 1.00 HSD17B10 (1.00) HSD17B10TSHRRARBALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108485682-B Method for regulating orientation of liquid crystal molecules through special rod-shaped molecules or polymers thereof 湘潭大学 2021-11-09 CN claimed
CN-110333612-B Method for preparing multi-response intelligent window through liquid crystal polymer modified carbon nano tube 湘潭大学 2021-10-01 CN claimed
CN-107916116-B Method for regulating and controlling liquid crystal interval of conventional liquid crystal molecules by using ultra-long rod-shaped liquid crystal micromolecules 湘潭大学 2021-05-25 CN claimed
US-7935394-B2 Polar nematic liquid crystal assembly and liquid crystal device using the same Korea University Industry and Academy Cooperation Foundation (KR) 2011-05-03 US claimed
US-20080273161-A1 Polar Nematic Liquid Crystal Assembly and Liquid Crystal Device Using the Same Korea University Industry and Academy Cooperation Foundation (KR) 2008-11-06 US claimed
US-7335405-B2 Nematic liquid crystal mixtures for use in bistable display devices NEMOPTIC (FR) 2008-02-26 US claimed
WO-2007037575-A1 POLAR NEMATIC LIQUID CRYSTAL ASSEMBLY AND LIQUID CRYSTAL DEVICE USING THE SAME Korea University Industry and Academy Cooperation Foundation (KR) 2007-04-05 WO claimed
US-20060249708-A1 Nematic liquid crystal mixtures for use in bistable display devices CDC PROPRIETE INTELLECTUELLE (FR) 2006-11-09 US claimed
EP-0345357-B1 LIQUID CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1992-12-23 EP claimed
EP-0166288-B1 LIQUID CRYSTAL BISTABLE STORAGE DEVICE International Business Machines Corporation (US) 1992-08-26 EP claimed
US-5085799-A Mixtures of cyanobiphenyls CHISSO CORPORATION (JP) 1992-02-04 US claimed
EP-0144683-B1 ALIGNMENT LAYER ORIENTATION IN LIQUID CRYSTAL DISPLAYS International Business Machines Corporation (US) 1990-01-03 EP claimed
EP-0345357-A1 LIQUID CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1989-12-13 EP claimed
US-4834906-A Smectic A liquid crystal compositions MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-05-30 US claimed
US-4770810-A Organic compound having a smectic phase A, and a mixture comprising this compound THOMSON-CSF (FR) 1988-09-13 US claimed
EP-0157679-B1 ORGANIC COMPOUND SHOWING A SMECTIC PHASE A, MIXTURE CONTAINING THIS COMPOUND AND PROCESS FOR MAKING IT THOMSON-CSF (FR) 1988-05-18 EP claimed
US-4617646-A Electric field gradient excited liquid crystal cell having bistability INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1986-10-14 US claimed
US-4614608-A LIQUID CRYSTALS; 1-(4-HYDROXYPHENYL)-2-(41-TRIFLUOROMETHYLPHENYL) ETHANE ESTERS THOMSON-CSF (FR) 1986-09-30 US claimed
EP-0166288-A2 Liquid crystal bistable storage device International Business Machines Corporation (US) 1986-01-02 EP claimed
EP-0144683-A2 Alignment layer orientation in liquid crystal displays International Business Machines Corporation (US) 1985-06-19 EP claimed