SCHEMBL9406502

SCHEMBL9406502

CC1CCC(C2CCC(CO)CC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.38
ESR1 P03372 6/20 0.34
ESR2 Q92731 6/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2C9 P11712 2/20 0.34
NR1H2 P55055 1/20 0.32
CYP2D6 P10635 1/20 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
SCHEMBL9406508 1.00 EPHX2 (0.38) EPHX2ESR1ESR2CYP3A4CYP2C9
SCHEMBL9406494 1.00 EPHX2 (0.38) EPHX2ESR1ESR2CYP3A4CYP2C9
SCHEMBL155951 0.92
SCHEMBL13164699 0.92
SCHEMBL3485266 0.92
SCHEMBL19884715 0.88 EPHX2 (0.39) EPHX2ESR1ESR2CYP3A4CYP2C9
SCHEMBL15177085 0.87 EPHX2 (0.31) EPHX2NR1H2
SCHEMBL15890456 0.86 ESR1 (0.41) ESR1ESR2CYP3A4CYP2C9CYP2D6
SCHEMBL31536508 0.86 ESR1 (0.41) ESR1ESR2CYP3A4CYP2C9CYP2D6
SCHEMBL28705863 0.86 ESR1 (0.41) ESR1ESR2CYP3A4CYP2C9CYP2D6

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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11214736-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2022-01-04 US disclosed
US-10824000-B2 Liquid crystal display device NISSAN CHEMICAL CORPORATION (JP) 2020-11-03 US disclosed
EP-3422092-B1 LIQUID CRYSTAL DISPLAY DEVICE NISSAN CHEMICAL CORP (JP) 2020-10-14 EP disclosed
EP-2931836-B1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2020-03-18 EP disclosed
EP-3263673-B1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2019-10-02 EP disclosed
US-20190284474-A1 SWITCHING LAYER FOR USE IN AN OPTICAL SWITCHING ELEMENT MERCK PATENT GMBH (DE) 2019-09-19 US disclosed
US-20190049797-A1 LIQUID CRYSTAL DISPLAY DEVICE NISSAN CHEMICAL CORPORATION (JP) 2019-02-14 US disclosed
EP-3422092-A1 LCD ELEMENT Nissan Chemical Corporation (JP) 2019-01-02 EP disclosed
EP-3130650-B1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2018-07-04 EP disclosed
US-20180171231-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2018-06-21 US disclosed
US-20150322342-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2015-11-12 US disclosed
US-20150166890-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2015-06-18 US disclosed
US-20140138581-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2014-05-22 US disclosed
US-20140138581-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2014-05-22 US disclosed
WO-2013004372-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2013-01-10 WO disclosed
WO-2012130380-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2012-10-04 WO disclosed
EP-1768199-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2007-03-28 EP disclosed
EP-0355552-B1 Alkoxymethyl- and alkenyloxymethyl-cyclohexanes HOFFMANN LA ROCHE (CH) 1994-02-23 EP disclosed
US-5102578-A Electrooptics HOFFMANN-LA ROCHE INC. (US) 1992-04-07 US disclosed
EP-0355552-A2 Alkoxymethyl- and alkenyloxymethyl-cyclohexanes F. HOFFMANN-LA ROCHE AG (CH) 1990-02-28 EP disclosed