SCHEMBL8414191

SCHEMBL8414191

CCCOC(C)CC(=O)CC(=O)O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
HDAC2 Q92769 2/20 0.31
FFAR3 O14843 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC8 Q9BY41 1/20 0.30

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
SCHEMBL5972166 0.89 ALDH1A1 (0.35)
SCHEMBL9782829 0.84 LMNA (0.33) FFAR3
SCHEMBL3788751 0.84 GPR84 (0.36) TDP1HDAC2FFAR3HDAC3HDAC1
SCHEMBL28339170 0.76 TSHR (0.37) TDP1
SCHEMBL6510861 0.75 LDHA (0.35) TDP1
SCHEMBL7619137 0.74 TDP1 (0.35) TDP1
SCHEMBL27735763 0.73 TDP1 (0.32) TDP1
SCHEMBL5691477 0.73 TET2 (0.41) TDP1
SCHEMBL16468423 0.73 FOLH1 (0.46) TDP1HDAC2HDAC1
SCHEMBL6381509 0.72 GABRP (0.45) TDP1HDAC2FFAR3HDAC3HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0931820-A1 Coating composition and its cured product JSR Corporation (JP) 1999-07-28 EP disclosed