SCHEMBL9858433

SCHEMBL9858433

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

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.60
SLC1A2 P43004 1/20 0.60
SLC1A1 P43005 1/20 0.60
TP53 P04637 1/20 0.43
TDP1 Q9NUW8 1/20 0.38
SLC7A5 Q01650 2/20 0.37
RNPEP Q9H4A4 1/20 0.37
FOLH1 Q04609 2/20 0.32
NAALAD2 Q9Y3Q0 2/20 0.32
ENPEP Q07075 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL26138067 0.82 SLC1A3 (0.58) SLC1A3SLC1A2SLC1A1TP53TDP1
SCHEMBL6870066 0.81 SLC1A3 (0.62) SLC1A3SLC1A2SLC1A1TP53TDP1
SCHEMBL2717757 0.81 SLC1A3 (0.62) SLC1A3SLC1A2SLC1A1TP53TDP1
SCHEMBL9213452 0.79 SLC1A3 (0.60) SLC1A3SLC1A2SLC1A1TP53TDP1
SCHEMBL9675574 0.78 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1TP53SLC7A5
SCHEMBL9676557 0.78 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1TP53SLC7A5
SCHEMBL27776026 0.78 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1TP53TDP1
SCHEMBL9675609 0.78 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1TP53SLC7A5
SCHEMBL9675622 0.78 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1TP53SLC7A5
SCHEMBL3059614 0.77 SLC1A3 (0.52) SLC1A3SLC1A2SLC1A1TP53TDP1

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-0408255-A1 Thermoplastic resin composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-01-16 EP disclosed
EP-0381391-A2 Resin composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-08-08 EP disclosed