SCHEMBL3609976

SCHEMBL3609976

C=CC(=O)Oc1ccc(OC(=O)c2ccc(CCCCC)cc2)cc1

nearest known ligand 0.84

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
THRB P10828 12/20 0.84
THRA P10827 10/20 0.61
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
MAPT P10636 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
NPC1 O15118 1/20 0.48
LMNA P02545 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
PLA2G1B P04054 1/20 0.48
ATG4B Q9Y4P1 1/20 0.48
RARB P10826 1/20 0.48
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47

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
SCHEMBL13906786 0.99 THRB (0.82) THRBTHRAMEN1KMT2AMAPT
SCHEMBL3618792 0.96 THRB (0.76) THRBTHRAMEN1KMT2AMAPT
SCHEMBL14373507 0.93 THRB (0.72) THRBTHRAMEN1KMT2AMAPT
SCHEMBL11031162 0.92 THRB (1.00) THRBTHRAMEN1KMT2ALMNA
SCHEMBL1493815 0.91 THRB (0.70) THRBTHRAMEN1KMT2AMAPT
SCHEMBL4578159 0.91 THRB (0.76) THRBTHRAMEN1KMT2AMAPT
SCHEMBL3613955 0.90 THRB (0.82) THRBTHRAMEN1KMT2AMAPT
SCHEMBL2289080 0.90 THRB (0.97) THRBTHRAMEN1KMT2ALMNA
SCHEMBL187096 0.90 THRB (0.97) THRBTHRAMEN1KMT2ALMNA
SCHEMBL4475071 0.90 THRB (0.97) THRBTHRAMEN1KMT2ALMNA

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-7738346-B2 Polarizing diffraction element and optical head device ASAHI GLASS COMPANY, LIMITED (JP) 2010-06-15 US disclosed
US-20060239171-A1 Polarizing diffraction element and optical head device ASAHI GLASS COMPANY LIMITED (JP) 2006-10-26 US disclosed
EP-1698917-A1 POLARIZING DIFFRACTION ELEMENT AND OPTICAL HEAD DEVICE Asahi Glass Company, Limited (JP) 2006-09-06 EP disclosed
US-6562259-B1 Photopolymerizable liquid crystal monomer is a 4-(4-(alkyloxycarbonyloxy)benzoyloxy)phenyl acrylate; optical head employing the optical element as a polarizing hologram element ASAHI GLASS COMPANY, LIMITED (JP) 2003-05-13 US disclosed