SCHEMBL28756993

SCHEMBL28756993

C=C(C)C([O])=O.CCC1(C(=O)O)CCCCC1C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 1/20 0.31

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
Methacrylic Acid SCHEMBL28301908 0.94 KARS1 (0.31) KARS1
SCHEMBL729244 0.91 ALDH1A1 (0.33)
Water SCHEMBL28120356 0.89 ALDH1A1 (0.32)
SCHEMBL29150534 0.82 PPM1B (0.33)
SCHEMBL4811803 0.79
SCHEMBL28867035 0.78 SLC1A2 (0.34)
SCHEMBL4820580 0.78 ALDH1A1 (0.31)
SCHEMBL27809564 0.77 GRM2 (0.32)
SCHEMBL5888874 0.77 GRM2 (0.33)
SCHEMBL15253486 0.76 THRB (0.36)

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
CN-1814674-A Activity energy-line solidifying type resin composition NIPPON SYNTHESIE CHEMICAL INDU (JP) 2006-08-09 CN disclosed