SCHEMBL16640703

SCHEMBL16640703

CN(CN(C(=O)OC(C)(C)C)c1ccc(N)cc1)c1ccc(N)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PHLPP2 Q6ZVD8 1/20 0.37
CYP3A4 P08684 4/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPK1 P28482 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
TP53 P04637 1/20 0.35
ALOX15 P16050 1/20 0.35
AAK1 Q2M2I8 1/20 0.34
PAX8 Q06710 1/20 0.33
TSHR P16473 2/20 0.33
PSMD14 O00487 1/20 0.33
RECQL P46063 1/20 0.33
GFER P55789 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MT-CO2 P00403 1/20 0.32
MAOA P21397 2/20 0.32
LMNA P02545 1/20 0.32
CYP1A2 P05177 1/20 0.32
NR1H2 P55055 1/20 0.32
F2 P00734 3/20 0.31

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
SCHEMBL16640702 0.91 PHLPP2 (0.37) PHLPP2CYP3A4ALDH1A1MAPK1TDP1
SCHEMBL18011040 0.84 CYP3A4 (0.41) PHLPP2CYP3A4ALDH1A1MAPK1TDP1
SCHEMBL4738587 0.83 TSHR (0.43) CYP3A4ALDH1A1MAPK1TDP1TSHR
SCHEMBL55543 0.82 PHLPP2 (0.43) PHLPP2CYP3A4ALDH1A1MAPK1TDP1
SCHEMBL16640701 0.81 NR1H4 (0.38)
SCHEMBL27696712 0.81 CYP3A4 (0.36) PHLPP2CYP3A4ALDH1A1MAPK1TDP1
SCHEMBL3375082 0.81 MLYCD (0.38) CYP3A4MEN1CYP2C9CYP2C19KMT2A
SCHEMBL16142413 0.81 L3MBTL1 (0.40) PHLPP2CYP3A4ALDH1A1PAX8L3MBTL1
SCHEMBL28836938 0.81 SSTR4 (0.38) PHLPP2CYP3A4ALDH1A1MAPK1TDP1
SCHEMBL23329003 0.79 GBA1 (0.42) PHLPP2CYP3A4ALDH1A1MAPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9909065-B2 Liquid crystal aligning agents for forming photo-aligning liquid crystal alignment layers, liquid crystal alignment layers and liquid crystal display devices using the same JNC CORPORATION (JP) 2018-03-06 US disclosed
US-20170327744-A1 LIQUID CRYSTAL ALIGNING AGENTS FOR FORMING PHOTO-ALIGNING LIQUID CRYSTAL ALIGNMENT LAYERS, LIQUID CRYSTAL ALIGNMENT LAYERS AND LIQUID CRYSTAL DISPLAY DEVICES USING THE SAME JNC CORP (JP) 2017-11-16 US disclosed
US-9796927-B2 Liquid crystal aligning agents for forming photo-aligning liquid crystal alignment layers, liquid crystal alignment layers and liquid crystal display devices using the same JNC CORPORATION (JP) 2017-10-24 US disclosed
US-20150119522-A1 LIQUID CRYSTAL ALIGNING AGENTS FOR FORMING PHOTO-ALIGNING LIQUID CRYSTAL ALIGNMENT LAYERS, LIQUID CRYSTAL ALIGNMENT LAYERS AND LIQUID CRYSTAL DISPLAY DEVICES USING THE SAME JNC CORPORATION (JP) 2015-04-30 US disclosed
US-20150105503-A1 LIQUID CRYSTAL ALIGNING AGENTS FOR FORMING PHOTO-ALIGNING LIQUID CRYSTAL ALIGNMENT LAYERS, LIQUID CRYSTAL ALIGNMENT LAYERS AND LIQUID CRYSTAL DISPLAY DEVICES USING THE SAME JNC PETROCHEMICAL CORPORATION (JP) 2015-04-16 US disclosed