SCHEMBL29315916

SCHEMBL29315916

C=CC(=O)OCCC(=O)Oc1ccc(-c2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.54
MMP3 P08254 1/20 0.41
ASAH1 Q13510 1/20 0.41
PDE6D O43924 1/20 0.41
HDAC3 O15379 4/20 0.40
HDAC4 P56524 4/20 0.40
HDAC1 Q13547 4/20 0.40
HDAC7 Q8WUI4 4/20 0.40
HDAC2 Q92769 4/20 0.40
HDAC10 Q969S8 4/20 0.40
HDAC11 Q96DB2 4/20 0.40
HDAC8 Q9BY41 4/20 0.40
HDAC6 Q9UBN7 4/20 0.40
HDAC9 Q9UKV0 4/20 0.40
HDAC5 Q9UQL6 4/20 0.40
KMT2A Q03164 5/20 0.40
MEN1 O00255 2/20 0.40
TSHR P16473 5/20 0.39
ALDH1A1 P00352 4/20 0.39
HSD17B10 Q99714 2/20 0.39

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
SCHEMBL29315919 0.92 THRB (0.51) THRBMMP3ASAH1PDE6DHDAC3
SCHEMBL27131524 0.92 THRB (0.58) THRBMMP3ASAH1PDE6DHDAC3
SCHEMBL18027478 0.91 THRB (0.64) THRBKMT2ATSHRALDH1A1HSD17B10
SCHEMBL29315923 0.91 THRB (0.50) THRBPDE6DHDAC3HDAC4HDAC1
SCHEMBL29315983 0.89 THRB (0.56) THRBMMP3HDAC3HDAC4HDAC1
SCHEMBL29315929 0.89 HDAC3 (0.49) THRBHDAC3HDAC4HDAC1HDAC7
SCHEMBL29315925 0.89 HDAC3 (0.49) THRBHDAC3HDAC4HDAC1HDAC7
SCHEMBL29316362 0.89 THRB (0.52) THRBMMP3HDAC3HDAC4HDAC1
SCHEMBL19978539 0.85 THRB (0.53) THRBMMP3PDE6DKMT2ATSHR
SCHEMBL29315967 0.84 THRB (0.59) THRBMMP3PDE6DHDAC3HDAC4

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
US-20240239934-A1 FUMARIC ACID DIESTER RESIN, FILM AND POLARIZING PLATE TOSOH CORPORATION (JP) 2024-07-18 US disclosed
US-20240239934-A1 FUMARIC ACID DIESTER RESIN, FILM AND POLARIZING PLATE TOSOH CORPORATION (JP) 2024-07-18 US disclosed