SCHEMBL29264606

SCHEMBL29264606

CO[Ti](OC)OC.C[C]1C2=C(CCCC2)c2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.33
SLC6A3 Q01959 2/20 0.33
SLC6A4 P31645 1/20 0.33

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
SCHEMBL22492236 0.85 TSHR (0.35) SLC6A2SLC6A3SLC6A4
SCHEMBL22492269 0.83 TSHR (0.31)
SCHEMBL29133072 0.73 TSHR (0.47) SLC6A2SLC6A3SLC6A4
SCHEMBL29264583 0.71 SLC6A2 (0.31) SLC6A2SLC6A3SLC6A4
SCHEMBL29264562 0.66
SCHEMBL29264574 0.63
SCHEMBL9551924 0.63 MEN1 (0.47) SLC6A2SLC6A3SLC6A4
Phentydrone SCHEMBL8610402 0.62 ALDH1A1 (0.41)
Phentydrone SCHEMBL875187 0.62 MEN1 (0.57)
Phentydrone SCHEMBL14810401 0.62 ELANE (0.46)

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-111433231-B Method for producing styrene resin and styrene resin molded body 出光兴产株式会社 2024-07-16 CN disclosed