SCHEMBL16265261

SCHEMBL16265261

C=CC(=O)Oc1ccc(/C(CC)=C(\C)c2ccc(OC(=O)C=C)c(OC(=O)C=C)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.46
KMT2A Q03164 2/20 0.46
ESR1 P03372 1/20 0.46
RECQL P46063 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HIF1A Q16665 1/20 0.46
KDM4E B2RXH2 2/20 0.39
TSHR P16473 2/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.39
THRA P10827 1/20 0.37
NR1I2 O75469 2/20 0.36
PTGS2 P35354 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
BLM P54132 1/20 0.35
STS P08842 1/20 0.35
ELANE P08246 1/20 0.34
TOP1 P11387 1/20 0.34
PTGS1 P23219 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
SCHEMBL16265310 0.93 TSHR (0.42) THRBKMT2AESR1RECQLSMN1; SMN2
SCHEMBL16265262 0.91 ESR1 (0.53) THRBKMT2AESR1RECQLSMN1; SMN2
SCHEMBL16265313 0.90 THRB (0.47) THRBKMT2AESR1RECQLSMN1; SMN2
SCHEMBL16265311 0.86 RAB9A (0.37) THRBKDM4ETSHRALDH1A1GAA
SCHEMBL16265259 0.86 THRB (0.49) THRBKMT2ASMN1; SMN2KDM4ETSHR
SCHEMBL16265304 0.85 THRB (0.47) THRBKMT2AESR1RECQLSMN1; SMN2
SCHEMBL15338895 0.83 TSHR (0.50) THRBKMT2ASMN1; SMN2KDM4ETSHR
SCHEMBL16265255 0.83 ELANE (0.49) KMT2AESR1RECQLSMN1; SMN2HIF1A
SCHEMBL2583120 0.82 ESR1 (0.66) THRBKMT2AESR1RECQLSMN1; SMN2
SCHEMBL29655867 0.82 ESR1 (0.66) THRBKMT2AESR1RECQLSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9139672-B2 Polymerizable compound, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2015-09-22 US disclosed
US-9139672-B2 Polymerizable compound, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2015-09-22 US disclosed
US-20140346399-A1 POLYMERIZABLE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-11-27 US disclosed
US-20140346399-A1 POLYMERIZABLE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-11-27 US disclosed