SCHEMBL27670232

SCHEMBL27670232

O=C(O)C(I)CC(I)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 2/20 0.33
TSHR P16473 2/20 0.33
ALDH1A1 P00352 2/20 0.33
RNPEP Q9H4A4 1/20 0.33
OR51E2 Q9H255 1/20 0.33
SLC7A5 Q01650 1/20 0.33
LMNA P02545 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
THRB P10828 1/20 0.33
RECQL P46063 1/20 0.33
ENPEP Q07075 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL7247500 0.86 GABRR1 (0.39) GABRR1TSHRRNPEPOR51E2SLC7A5
SCHEMBL3134446 0.86 GABRR1 (0.39) GABRR1TSHRRNPEPOR51E2SLC7A5
SCHEMBL19513319 0.76
SCHEMBL12070645 0.76
SCHEMBL9294414 0.76
SCHEMBL6914660 0.73
SCHEMBL6916025 0.73
SCHEMBL6917078 0.73
SCHEMBL6915596 0.73
SCHEMBL13083532 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101952239-A Alicyclic structure-containing compound, (meth) acrylic acid esters and process for producing the same IDEMITSU KOSAN CO 2011-01-19 CN disclosed
CN-1984981-B Lubricating oil additive containing acrylic polymer and lubricating oil composition KURARAY CO 2010-11-17 CN disclosed
CN-1984981-A Lubricating oil additive containing acrylic polymer and lubricating oil composition KURARAY CO (JP) 2007-06-20 CN disclosed