SCHEMBL19853824

SCHEMBL19853824

CCCCCC1CCC(C2CCC(CC(=O)CC(=O)OCC)CC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MGAM O43451 1/20 0.38
GAA P10253 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
TP53 P04637 1/20 0.38
PKM P14618 1/20 0.37
FAAH O00519 2/20 0.37
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
NAAA Q02083 3/20 0.36
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
ALOX15 P16050 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL7527425 0.88 PKM (0.40) EPHX2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL21706895 0.84 PKM (0.43) CYP1A2CYP2D6CYP2C9CYP2C19MGAM
SCHEMBL1015154 0.83 GAA (0.54) EPHX2CYP1A2MGAMGAASI
SCHEMBL19853866 0.82 ALDH1A1 (0.47) EPHX2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL7519023 0.81 PKM (0.47) CYP1A2CYP2D6CYP2C9CYP2C19TP53
SCHEMBL9289506 0.77 TLR4 (0.40) EPHX2CYP2C9MGAMGAASI
SCHEMBL10793775 0.77 ALDH1A1 (0.50) CYP1A2CYP2D6CYP2C9CYP2C19GAA
SCHEMBL10793779 0.77 ALDH1A1 (0.50) CYP1A2CYP2D6CYP2C9CYP2C19GAA
SCHEMBL3109485 0.77 GAA (0.50) CYP2D6MGAMGAASIMGAM2
SCHEMBL2555598 0.77 MGAM (0.50) EPHX2CYP2D6MGAMGAASI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210214615-A1 LIQUID CRYSTAL DISPLAY DEVICE AND DISPLAY UNIT JNC CORPORATION (JP) 2021-07-15 US disclosed
US-10982146-B2 Liquid crystal composition, liquid crystal element, and use of liquid crystal composition in liquid crystal element JNC CORPORATION (JP) 2021-04-20 US disclosed
US-10428275-B2 Method for manufacturing liquid crystal display device and liquid crystal display device JNC CORPORATION (JP) 2019-10-01 US disclosed
US-20190225887-A1 METHOD FOR MANUFACTURING LIQUID CRYSTAL DISPLAY DEVICE AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2019-07-25 US disclosed
US-20190225886-A1 LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL ELEMENT, AND USE OF LIQUID CRYSTAL COMPOSITION IN LIQUID CRYSTAL ELEMENT JNC CORPORATION (JP) 2019-07-25 US disclosed
EP-3466918-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2019-04-10 EP disclosed
WO-2018025974-A1 LIQUID-CRYSTAL DISPLAY ELEMENT AND DISPLAY DEVICE JNC株式会社 2018-02-08 WO disclosed