SCHEMBL28667115

SCHEMBL28667115

O=C(O)COCC(Cl)(Cl)Cl

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.38
CTH P32929 1/20 0.38
CBS P35520 1/20 0.38
THPO P40225 1/20 0.38
THRB P10828 1/20 0.36
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
PTGS1 P23219 1/20 0.31
KMT2A Q03164 1/20 0.30
ALOX15 P16050 1/20 0.30

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
SCHEMBL14963629 0.78 TSHR (0.41) TSHRCTHCBSTHPOTHRB
SCHEMBL935982 0.77 TET2 (0.33) ALOX15
SCHEMBL510917 0.75 LMNA (0.36) TSHRALDH1A1
SCHEMBL28095571 0.75 TSHR (0.35) TSHRCTHCBSTHPOTHRB
SCHEMBL7263770 0.75 BLM (0.31)
Hydrochloric Acid SCHEMBL9903552 0.75 TET2 (0.32)
SCHEMBL724846 0.74 TSHR (0.38) TSHRCTHCBSTHPOTHRB
SCHEMBL703051 0.74 TSHR (0.38) TSHRCTHCBSTHPOTHRB
SCHEMBL816275 0.74 ALDH1A1 (0.42) TSHRCTHCBSTHPOTHRB
SCHEMBL14001521 0.74 TSHR (0.43) TSHRCTHCBSTHPOTHRB

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-113951264-B Herbicidal composition, herbicide and weeding method 迈克斯(如东)化工有限公司 2024-01-19 CN disclosed
CN-113951264-A Herbicidal composition, herbicide and weeding method 迈克斯(如东)化工有限公司 2022-01-21 CN disclosed