SCHEMBL9317404

SCHEMBL9317404

C=CC(=O)OCCCCCCOc1ccc(C=Cc2ccc(S(=O)(=O)c3ccccc3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.54
PPARA Q07869 3/20 0.51
ALB P02768 1/20 0.47
ALDH1A1 P00352 2/20 0.44
CYP3A4 P08684 1/20 0.44
TSHR P16473 1/20 0.44
CHRNA7 P36544 9/20 0.43
HTT P42858 1/20 0.43
CHRNA10 Q9GZZ6 3/20 0.42
CHRNA9 Q9UGM1 3/20 0.42
FFAR1 O14842 1/20 0.41
PPARG P37231 1/20 0.41
PPARD Q03181 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41

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
SCHEMBL9317811 0.93 THRB (0.64) THRBPPARAALBALDH1A1CHRNA7
SCHEMBL9317806 0.93 THRB (0.64) THRBPPARAALBALDH1A1CHRNA7
SCHEMBL9317473 0.87 THRB (0.53) THRBPPARAALDH1A1CYP3A4TSHR
SCHEMBL9317477 0.87 THRB (0.53) THRBPPARAALDH1A1CYP3A4TSHR
SCHEMBL12769641 0.87 THRB (0.44) THRBPPARAALBALDH1A1CYP3A4
SCHEMBL13697348 0.86 TSHR (0.59) THRBPPARAALBALDH1A1CYP3A4
SCHEMBL12769648 0.86 THRB (0.45) THRBPPARAALBALDH1A1CYP3A4
SCHEMBL9318756 0.86 THRB (0.47) THRBPPARAALBALDH1A1CYP3A4
SCHEMBL9317118 0.85 ALDH1A1 (0.41) THRBPPARAALDH1A1CYP3A4TSHR
SCHEMBL9317121 0.85 ALDH1A1 (0.41) THRBPPARAALDH1A1CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5322986-A Methods for preparing polymer stripe waveguides and polymer stripe waveguides prepared thereby EASTMAN KODAK COMPANY (US) 1994-06-21 US disclosed
US-5075796-A OPTICAL ARTICLE FOR MULTICOLOR IMAGING EASTMAN KODAK COMPANY (US) 1991-12-24 US disclosed
EP-0422725-A2 High x(2) optical article EASTMAN KODAK COMPANY (US) 1991-04-17 EP disclosed
EP-0422723-A2 Optical article for reflection modulation EASTMAN KODAK COMPANY (US) 1991-04-17 EP disclosed
US-4948225-A REFLECTIVE METAL LAYER, DIELECTRICS, PROTECTIVE COATING EASTMAN KODAK COMPANY (US) 1990-08-14 US disclosed