SCHEMBL9999769

SCHEMBL9999769

COC(C(=O)c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccc(C)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.56
RAB9A P51151 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
KEAP1 Q14145 1/20 0.51
NFE2L2 Q16236 1/20 0.51
ALDH1A1 P00352 4/20 0.50
LMNA P02545 4/20 0.50
HTT P42858 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
KDM4E B2RXH2 1/20 0.50
CYP3A4 P08684 4/20 0.48
CYP2C19 P33261 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
PKM P14618 1/20 0.48
TDP1 Q9NUW8 1/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
MEN1 O00255 1/20 0.46
NPC1 O15118 1/20 0.46

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
SCHEMBL9999774 1.00 NPSR1 (0.56) NPSR1RAB9AL3MBTL1KEAP1NFE2L2
SCHEMBL9999768 0.94 ALDH1A1 (0.51) NPSR1RAB9AL3MBTL1ALDH1A1LMNA
SCHEMBL6223942 0.91 NPSR1 (0.65) NPSR1RAB9AL3MBTL1KEAP1NFE2L2
SCHEMBL6203941 0.89 NPSR1 (0.54) NPSR1RAB9AL3MBTL1KEAP1NFE2L2
SCHEMBL26160 0.80 ALDH1A1 (0.68) NPSR1RAB9AL3MBTL1ALDH1A1LMNA
SCHEMBL10018352 0.80 ALDH1A1 (0.68) NPSR1RAB9AL3MBTL1ALDH1A1LMNA
SCHEMBL28589539 0.79 ALDH1A1 (0.57) NPSR1RAB9AL3MBTL1ALDH1A1SMN1; SMN2
Water SCHEMBL23466907 0.79 ALDH1A1 (0.66) NPSR1RAB9AL3MBTL1ALDH1A1LMNA
Methoxymethane SCHEMBL28231191 0.79 ALDH1A1 (0.66) NPSR1RAB9AL3MBTL1ALDH1A1LMNA
SCHEMBL5036096 0.79 PTGS2 (0.58) L3MBTL1KEAP1NFE2L2ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2418536-A1 LIQUID CRYSTAL DISPLAY DEVICE, METHOD FOR MANUFACTURING LIQUID CRYSTAL DISPLAY DEVICE, COMPOSITION FOR FORMING POLYMER LAYER, AND COMPOSITION FOR FORMING LIQUID CRYSTAL LAYER Sharp Kabushiki Kaisha (JP) 2012-02-15 EP disclosed
US-20120033167-A1 LIQUID CRYSTAL DISPLAY DEVICE, METHOD FOR MANUFACTURING LIQUID CRYSTAL DISPLAY DEVICE, COMPOSITION FOR FORMING POLYMER LAYER, AND COMPOSITION FOR FORMING LIQUID CRYSTAL LAYER SHARP KABUSHIKI KAISHA (JP) 2012-02-09 US disclosed
US-20120033167-A1 LIQUID CRYSTAL DISPLAY DEVICE, METHOD FOR MANUFACTURING LIQUID CRYSTAL DISPLAY DEVICE, COMPOSITION FOR FORMING POLYMER LAYER, AND COMPOSITION FOR FORMING LIQUID CRYSTAL LAYER SHARP KABUSHIKI KAISHA (JP) 2012-02-09 US disclosed