SCHEMBL10021164

SCHEMBL10021164

CCCC1CCC(C2CCC(C(O)C(F)(F)C(=O)OCC)CC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 1/20 0.34
MAPT P10636 1/20 0.32
HIF1A Q16665 1/20 0.32
CYP2C9 P11712 1/20 0.31
MMP8 P22894 2/20 0.31
METAP2 P50579 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL14955260 0.79
SCHEMBL14954978 0.78 TLR4 (0.36) TLR4MAPTHIF1ACYP2C9
SCHEMBL10021482 0.78 TLR4 (0.34) TLR4CYP2C9METAP2L3MBTL1
SCHEMBL14955049 0.76 TLR4 (0.33) TLR4
SCHEMBL10021028 0.72 L3MBTL1 (0.35) MAPTCYP2C9METAP2L3MBTL1
SCHEMBL10021483 0.72 TLR4 (0.36) TLR4MAPTCYP2C9METAP2L3MBTL1
SCHEMBL10355262 0.72 L3MBTL1 (0.50) MAPTCYP2C9METAP2L3MBTL1
SCHEMBL6838714 0.72 L3MBTL1 (0.50) MAPTCYP2C9METAP2L3MBTL1
SCHEMBL6750673 0.72 TLR4 (0.38) TLR4MAPTCYP2C9
SCHEMBL6746586 0.72 TLR4 (0.38) TLR4MAPTCYP2C9

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-8846164-B2 Compound having propyl ether as bonding group, liquid crystal composition thereof and liquid crystal display device thereof JNC CORPORATION (JP) 2014-09-30 US disclosed
US-8846164-B2 Compound having propyl ether as bonding group, liquid crystal composition thereof and liquid crystal display device thereof JNC CORPORATION (JP) 2014-09-30 US disclosed
US-8846164-B2 Compound having propyl ether as bonding group, liquid crystal composition thereof and liquid crystal display device thereof JNC CORPORATION (JP) 2014-09-30 US disclosed
US-20130126783-A1 COMPOUND HAVING PROPYL ETHER AS BONDING GROUP, LIQUID CRYSTAL COMPOSITION THEREOF AND LIQUID CRYSTAL DISPLAY DEVICE THEREOF JNC PETROCHEMICAL CORPORATION (JP) 2013-05-23 US disclosed
US-20130126783-A1 COMPOUND HAVING PROPYL ETHER AS BONDING GROUP, LIQUID CRYSTAL COMPOSITION THEREOF AND LIQUID CRYSTAL DISPLAY DEVICE THEREOF JNC PETROCHEMICAL CORPORATION (JP) 2013-05-23 US disclosed
US-20130126783-A1 COMPOUND HAVING PROPYL ETHER AS BONDING GROUP, LIQUID CRYSTAL COMPOSITION THEREOF AND LIQUID CRYSTAL DISPLAY DEVICE THEREOF JNC PETROCHEMICAL CORPORATION (JP) 2013-05-23 US disclosed
WO-2012020643-A1 COMPOUND HAVING PROPYL ETHER AS BONDING GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC株式会社 (JP) 2012-02-16 WO disclosed