SCHEMBL17070441

SCHEMBL17070441

C=C(C)C(=O)Oc1cc(-c2ccc(CCO)cc2CC)c(OC(=O)C(=C)C)cc1CCc1ccc(CCCCC)cc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRB P10828 7/20 0.40
THRA P10827 6/20 0.40
RARB P10826 2/20 0.36
PPARA Q07869 2/20 0.35
PPARG P37231 1/20 0.35
KAT8 Q9H7Z6 3/20 0.34
EP300 Q09472 1/20 0.34
KAT5 Q92993 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALOX5 P09917 1/20 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
SCHEMBL17070392 0.97 THRB (0.41) THRBTHRARARBPPARAPPARG
SCHEMBL17070433 0.96 THRB (0.40) THRBTHRARARBPPARAPPARG
SCHEMBL17070470 0.94 THRB (0.40) THRBTHRARARBPPARAPPARG
SCHEMBL17070439 0.92 THRB (0.42) THRBTHRARARBPPARAPPARG
SCHEMBL17070425 0.90 THRB (0.37) THRBTHRARARBPPARAPPARG
SCHEMBL17070427 0.90 THRB (0.37) THRBTHRARARBPPARAPPARG
SCHEMBL17070434 0.89 THRB (0.36) THRBTHRARARBPPARAPPARG
SCHEMBL17070391 0.89 THRB (0.38) THRBTHRARARBPPARAPPARG
SCHEMBL17070436 0.88 THRB (0.36) THRBTHRARARBPPARAPPARG
SCHEMBL17070365 0.88 THRB (0.42) THRBTHRARARBPPARAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3730590-A1 LIQUID CRYSTAL MEDIA WITH HOMEOTROPIC ALIGNMENT Merck Patent GmbH (DE) 2020-10-28 EP disclosed
EP-2918658-B1 Liquid crystalline media with homeotropic alignment MERCK PATENT GMBH (DE) 2020-05-13 EP disclosed
US-10513657-B2 Liquid-crystalline media having homeotropic alignment MERCK PATENT GMBH (DE) 2019-12-24 US disclosed
US-20180057743-A1 LIQUID-CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2018-03-01 US disclosed
US-20180057743-A1 LIQUID-CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2018-03-01 US disclosed
US-9809748-B2 Liquid-crystalline media having homeotropic alignment MERCK PATENT GMBH (DE) 2017-11-07 US disclosed
US-9809748-B2 Liquid-crystalline media having homeotropic alignment MERCK PATENT GMBH (DE) 2017-11-07 US disclosed
EP-2918658-A2 Liquid crystalline media with homeotropic alignment Merck Patent GmbH (DE) 2015-09-16 EP disclosed
US-20150252265-A1 LIQUID-CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2015-09-10 US disclosed
US-20150252265-A1 LIQUID-CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2015-09-10 US disclosed