SCHEMBL11986103

SCHEMBL11986103

C=C(C)C(=O)OCOc1ccc(C=CC(=O)Oc2ccc(C(c3ccc(OC(=O)C=Cc4ccc(OCOC(=O)C(=C)C)cc4C)cc3)(C(F)(F)F)C(F)(F)F)cc2)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 2/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
ESR1 P03372 3/20 0.39
CYP1A1 P04798 5/20 0.35
CYP1B1 Q16678 5/20 0.35
MAOB P27338 3/20 0.35
GSTP1 P09211 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
MLYCD O95822 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
S1PR1 P21453 1/20 0.31
POLB P06746 1/20 0.30
APEX1 P27695 1/20 0.30
HTT P42858 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
SCHEMBL11986144 0.90 MAOB (0.35) PPARDPPARGPPARAESR1CYP1A1
SCHEMBL12154300 0.88 ESR1 (0.40) PPARDPPARGPPARAESR1CYP1A1
SCHEMBL11986149 0.85 CYP1A1 (0.42) PPARACYP1A1CYP1B1MAOBKDM4E
SCHEMBL11986101 0.83 POLB (0.39) PPARDPPARGPPARAESR1MAOB
SCHEMBL11986087 0.82 GSTP1 (0.40) PPARDGSTP1TDP1KDM4EALDH1A1
SCHEMBL16425293 0.81 GSTP1 (0.39) PPARDPPARAMAOBGSTP1TDP1
SCHEMBL13932673 0.80 PPARD (0.35) PPARDPPARGPPARAGSTP1TDP1
SCHEMBL13289543 0.79 ADORA3 (0.34) PPARAESR1TDP1KDM4EALDH1A1
SCHEMBL16425290 0.79 ESR1 (0.33) PPARDPPARGPPARAESR1GSTP1
SCHEMBL16425287 0.79 ESR1 (0.33) PPARDPPARGPPARAESR1GSTP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9315728-B2 Polymerizable liquid crystal composition and homogeneous-aligned liquid crystal film JNC CORPORATION (JP) 2016-04-19 US disclosed
US-9080100-B2 Polymerizable liquid crystal composition JNC CORPORATION (JP) 2015-07-14 US disclosed
US-20150029446-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOSITION AND OPTICAL ANISOTROPIC FILM JNC PETROCHEMICAL CORPORATION (JP) 2015-01-29 US disclosed
US-8419973-B2 Polymerizable liquid crystal composition and homeotropically-aligned liquid crystal film JNC CORPORATION (JP) 2013-04-16 US disclosed
US-8246855-B2 Polymerizable liquid crystal composition and optically anisotropic film using the same JNC CORPORATION (JP) 2012-08-21 US disclosed
US-20100151154-A1 Polymerizable liquid crystal composition and homeotropically-aligned liquid crystal film CHISSO CORPORATION 2010-06-17 US disclosed
US-20100143612-A1 Polymerizable liquid crystal composition and homogeneous-aligned liquid crystal film CHISSO CORPORATION 2010-06-10 US disclosed
US-20100051866-A1 Polymerizable liquid crystal composition and optically anisotropic film using the same JNC PETROCHEMICAL CORPORATION (JP) 2010-03-04 US disclosed
US-7488519-B2 Polymerizable liquid crystal composition CHISSO CORPORATION (JP) 2009-02-10 US disclosed
US-7476423-B2 Polymerizable liquid crystal composition CHISSO CORPORATION (JP) 2009-01-13 US disclosed
US-20080241431-A1 Polymerizable liquid crystal composition CHISSO CORPORATION 2008-10-02 US disclosed
US-20080014374-A1 Polymerizable liquid crystal composition JNC PETROCHEMICAL CORPORATION (JP) 2008-01-17 US disclosed