SCHEMBL27319909

SCHEMBL27319909

COC(C)(C)OOC(C)(C)OC

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
TSHR P16473 2/20 0.36
TDP1 Q9NUW8 2/20 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
SCHEMBL2029244 0.89 TSHR (0.57) ALDH1A1TSHRTDP1
SCHEMBL49039 0.80
SCHEMBL21433576 0.78 TSHR (0.55) ALDH1A1TSHRTDP1
Hydrochloric Acid SCHEMBL27895817 0.76
SCHEMBL29989468 0.76
SCHEMBL77719 0.73 ALDH1A1 (0.46) ALDH1A1TSHRTDP1
Methyl Alcohol SCHEMBL6261246 0.73
Benzene SCHEMBL28325455 0.70 ALDH1A1 (0.43) ALDH1A1TSHRTDP1
SCHEMBL372797 0.67
SCHEMBL9591832 0.67

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
CN-1027497-C Methacrylic resin molded article and method for producing same KYOWA GAS CHEM IND CO LTD (JP) 1995-01-25 CN disclosed
CN-87100815-A Methacrylic resin molded article and method for producing same 1988-08-03 CN disclosed