SCHEMBL5208864

SCHEMBL5208864

C=CC(=O)OCC1CSC(c2ccc3cc(C4SCC(COC(=O)C=C)S4)ccc3c2)S1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 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
SCHEMBL6860926 0.95 THRB (0.36) THRB
SCHEMBL5208212 0.91 THRB (0.34) THRB
SCHEMBL5211705 0.89 THRB (0.37) THRB
SCHEMBL6856677 0.85 CA1 (0.36)
SCHEMBL6862965 0.85 GSK3B (0.32) THRB
SCHEMBL6860887 0.85 MAPT (0.36) THRB
SCHEMBL6863500 0.85 MAPT (0.33) THRB
SCHEMBL6856182 0.85 THRB (0.40) THRB
SCHEMBL5210291 0.84 THRB (0.38) THRB
SCHEMBL6863277 0.83 THRB (0.41) THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1388540-B1 ACRYLIC ESTERS AND USE THEREOF MITSUI CHEMICALS INC (JP) 2007-09-05 EP disclosed
EP-1388540-A1 ACRYLIC ESTERS AND USE THEREOF Mitsui Chemicals, Inc. (JP) 2004-02-11 EP disclosed