SCHEMBL17477145

SCHEMBL17477145

C=C(C)C(=O)Oc1ccc(CCc2ccc(-c3ccc(CCCO)cc3CC)c(F)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.36
THRB P10828 4/20 0.36
PPARA Q07869 1/20 0.36
ELANE P08246 1/20 0.35
CYP4A11 Q02928 2/20 0.34
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
THRA P10827 2/20 0.33
CYP4F2 P78329 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
PTGES O14684 1/20 0.32
ALOX5 P09917 1/20 0.32
S1PR1 P21453 1/20 0.32
PTGS2 P35354 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
SCHEMBL17484412 0.94 RARB (0.35) RARBTHRBPPARAELANECYP4A11
SCHEMBL17484350 0.94 PTGS2 (0.37) RARBTHRBPPARAELANECYP4A11
SCHEMBL17477156 0.88 POLB (0.41) RARBPPARAKMT2AFFAR4MAOA
SCHEMBL17484454 0.88 RARB (0.36) RARBTHRBPPARACYP4A11THRA
SCHEMBL17484463 0.87 ELANE (0.35) RARBPPARAELANECYP4A11KMT2A
SCHEMBL20412535 0.87 ELANE (0.33) RARBTHRBELANEKMT2AATM
SCHEMBL17484351 0.87 ELANE (0.41) THRBPPARAELANECYP4A11KMT2A
SCHEMBL17484348 0.85 THRB (0.32) RARBTHRBELANE
SCHEMBL17484405 0.83 RARB (0.36) RARBTHRBCYP4A11THRACYP4F2
SCHEMBL17484402 0.83 RARB (0.33) RARBTHRBELANEFFAR4S1PR1

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-3174955-B1 LIQUID CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2019-10-23 EP disclosed
EP-3174955-B1 LIQUID CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2019-10-23 EP disclosed
US-10294426-B2 Liquid crystalline media having homeotropic alignment MERCK PATENT GMBH (DE) 2019-05-21 US disclosed
US-10294426-B2 Liquid crystalline media having homeotropic alignment MERCK PATENT GMBH (DE) 2019-05-21 US disclosed
US-20180208848-A1 LIQUID CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2018-07-26 US disclosed
US-20180208848-A1 LIQUID CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2018-07-26 US disclosed
US-20180208848-A1 LIQUID CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2018-07-26 US disclosed
EP-3174955-A1 LIQUID CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT Merck Patent GmbH (DE) 2017-06-07 EP disclosed
WO-2016015803-A1 LIQUID CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2016-02-04 WO disclosed
WO-2016015803-A1 LIQUID CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2016-02-04 WO disclosed