SCHEMBL9502518

SCHEMBL9502518

CCCCCC1CCC(OC(=O)C2CCC(C3CCC(CCC)CC3)CC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.44
HTT P42858 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
NAAA Q02083 3/20 0.41
TP53 P04637 1/20 0.41
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.39
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
CCR2 P41597 1/20 0.38
MAPT P10636 3/20 0.37
GAA P10253 1/20 0.37
TLR4 O00206 1/20 0.35
LSS P48449 2/20 0.33

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
SCHEMBL10660736 1.00 PKM (0.44) PKMHTTMEN1KMT2ACYP1A2
SCHEMBL9560921 1.00 PKM (0.44) PKMHTTMEN1KMT2ACYP1A2
SCHEMBL10660725 1.00 PKM (0.44) PKMHTTMEN1KMT2ACYP1A2
SCHEMBL14302798 1.00 PKM (0.44) PKMHTTMEN1KMT2ACYP1A2
SCHEMBL9502512 1.00 PKM (0.44) PKMHTTMEN1KMT2ACYP1A2
SCHEMBL11045599 1.00 PKM (0.44) PKMHTTMEN1KMT2ACYP1A2
SCHEMBL9561904 1.00 PKM (0.44) PKMHTTMEN1KMT2ACYP1A2
SCHEMBL11045596 1.00 PKM (0.44) PKMHTTMEN1KMT2ACYP1A2
SCHEMBL11422757 0.99 HTT (0.45) PKMHTTMEN1KMT2ACYP1A2
SCHEMBL11416273 0.99 HTT (0.45) PKMHTTMEN1KMT2ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9963636-B2 Liquid crystal composition and liquid crystal display device using same DIC CORPORATION (JP) 2018-05-08 US disclosed
US-9938463-B2 Liquid crystal composition and liquid crystal display device using the same DIC CORPORATION (JP) 2018-04-10 US disclosed
US-20170355906-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME DIC CORPORATION (JP) 2017-12-14 US disclosed
US-9828549-B2 Liquid crystal composition, liquid crystal display device, and liquid crystal display DIC CORPORATION (JP) 2017-11-28 US disclosed
US-9822304-B2 Liquid crystal composition and liquid crystal display element containing the same DIC CORPORATION (JP) 2017-11-21 US disclosed
EP-2837670-B1 FLUOROBIPHENYL-CONTAINING COMPOSITION DAINIPPON INK & CHEMICALS (JP) 2017-09-27 EP disclosed
US-20170226419-A1 POLYMERIZABLE-MONOMER-CONTAINING LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAME DIC CORPORATION (JP) 2017-08-10 US disclosed
US-20170210986-A1 LIQUID CRYSTAL DISPLAY ELEMENT DIC CORPORATION (JP) 2017-07-27 US disclosed
US-20170210989-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME DIC CORPORATION (JP) 2017-07-27 US disclosed
WO-2017118464-A1 LIQUID-CRYSTALLINE MIXTURES MERCK PATENT GMBH (DE) 2017-07-13 WO disclosed
US-5188758-A Electrooptical display element using a supertwist liquid crystal having specified elastic constants MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1993-02-23 US disclosed
EP-0317587-B1 LIQUID CRYSTAL PHASE MERCK PATENT GmbH (DE) 1992-01-02 EP disclosed
US-5055224-A LIQUID CRYSTAL PHASE MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-10-08 US disclosed
US-4871470-A LIQUID CRYSTALS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-10-03 US disclosed
EP-0317587-A1 LIQUID CRYSTAL PHASE. MERCK PATENT GMBH (DE) 1989-05-31 EP disclosed
EP-0300009-A1 LIQUID CRYSTALLINE MIXTURE. MERCK PATENT GMBH (DE) 1989-01-25 EP disclosed
US-4799774-A Electrooptical display element using a supertwist liquid crystal having specified elastic constants MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-01-24 US disclosed
WO-1988009360-A1 LIQUID CRYSTAL PHASE MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1988-12-01 WO disclosed
WO-1988005803-A1 LIQUID CRYSTALLINE MIXTURE MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1988-08-11 WO disclosed
US-4229315-A FOR DISPLAY ELEMENTS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1980-10-21 US disclosed