SCHEMBL9860792

SCHEMBL9860792

C=C(C)C(=O)OC(C)(OOC(C)(C)C(C)C)OC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL9723371 0.79 ALDH1A1 (0.35) TSHRALDH1A1
SCHEMBL438463 0.76 TSHR (0.45) TSHRALDH1A1
Methacrylic Acid SCHEMBL471882 0.74 TSHR (0.41) TSHRALDH1A1
Ethane SCHEMBL2403295 0.74 TSHR (0.43) TSHRALDH1A1
SCHEMBL6571060 0.73 ALDH1A1 (0.50) TSHRALDH1A1
SCHEMBL10872187 0.72 THRB (0.38) TSHRALDH1A1
SCHEMBL8438763 0.70
SCHEMBL7166492 0.70 ALDH1A1 (0.42) TSHRALDH1A1
SCHEMBL9860832 0.70 ALDH1A1 (0.42) TSHRALDH1A1
Bicarbonate SCHEMBL25265467 0.69

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-0412572-A2 Thermoplastic resin composition and method for preparing the same NIPPON PETROCHEMICALS CO., LTD. (JP) 1991-02-13 EP disclosed