SCHEMBL17740426

SCHEMBL17740426

CC1(C)CC(C(=O)OCCCCCCCCOC(=O)C2CC(C)(C)N(O)C(C)(C)C2)CC(C)(C)N1O

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.34
GAA P10253 3/20 0.33
KDM4E B2RXH2 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HTT P42858 1/20 0.32
NAAA Q02083 1/20 0.32
ALDH1A1 P00352 1/20 0.31
ALOX15 P16050 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
PPARG P37231 3/20 0.30
GBA2 Q9HCG7 1/20 0.30
EPHX1 P07099 1/20 0.30

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
SCHEMBL16710259 0.86 GAA (0.33) GAAKDM4EL3MBTL1HTTALDH1A1
SCHEMBL18770956 0.83 GAA (0.32) GAAL3MBTL1HTT
SCHEMBL1813546 0.82 CYP3A4 (0.44) ALDH1A1CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL21103469 0.81 GAA (0.40) GAAKDM4EL3MBTL1NAAA
SCHEMBL21908617 0.81 GAA (0.40) GAAKDM4EL3MBTL1NAAA
SCHEMBL21908621 0.81 GAA (0.40) GAAKDM4EL3MBTL1NAAA
SCHEMBL21908620 0.81 GAA (0.40) GAAKDM4EL3MBTL1NAAA
SCHEMBL21908619 0.79 GAA (0.41) GAAKDM4EL3MBTL1
SCHEMBL13644843 0.79 ACHE (0.35)
SCHEMBL13644863 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10330981-B2 Liquid crystal display device SAMSUNG DISPLAY CO., LTD. (KR) 2019-06-25 US disclosed
US-20160131947-A1 LIQUID CRYSTAL DISPLAY DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-05-12 US disclosed