SCHEMBL3843423

SCHEMBL3843423

C=C(C)C(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)CCOC(=O)C(=C)C

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.48
TSHR P16473 3/20 0.47
ALDH1A1 P00352 2/20 0.38
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL30360194 0.98 THRB (0.47) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL156101 0.95 THRB (0.44) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL1536925 0.93 THRB (0.43) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL16174432 0.93 THRB (0.43) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL1536991 0.93 THRB (0.43) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL476532 0.93 THRB (0.43) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL2462841 0.93 THRB (0.43) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL712876 0.93 THRB (0.43) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL1415453 0.93 THRB (0.43) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL1536824 0.93 THRB (0.43) THRBTSHRALDH1A1POLBAPEX1

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-20090148706-A1 OPTICAL WAVEGUIDE HAVING PERFLUOROADAMANTANE STRUCTURE OMRON CORPORATION (JP) 2009-06-11 US disclosed
EP-2015113-A1 OPTICAL WAVEGUIDE HAVING PERFLUOROADAMANTANE STRUCTURE Omron Corporation (JP) 2009-01-14 EP disclosed
US-20070041697-A1 Optical component OMRON CORPORATION (JP) 2007-02-22 US disclosed
EP-1693389-A1 OPTICAL COMPONENT Omron Corporation (JP) 2006-08-23 EP disclosed