SCHEMBL29008124

SCHEMBL29008124

C=C(C)C(=O)OCCC[SiH2]CCCOCC

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.66
TSHR P16473 7/20 0.54
ALDH1A1 P00352 6/20 0.40
POLB P06746 1/20 0.39
APEX1 P27695 1/20 0.39
HTT P42858 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CES2 O00748 1/20 0.30
HPGD P15428 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
SCHEMBL29198317 0.89 TSHR (0.60) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL1170964 0.88 THRB (0.78) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL234130 0.88 THRB (0.78) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL28330736 0.86 TSHR (0.62) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL8851536 0.86 THRB (0.75) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL3788969 0.86 THRB (0.75) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL8850592 0.86 THRB (0.75) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL3794443 0.86 THRB (0.75) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL8850956 0.86 THRB (0.75) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL8850646 0.86 THRB (0.75) THRBTSHRALDH1A1POLBAPEX1

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-116157915-A Thermosetting resin composition and semiconductor device 信越化学工业株式会社 2023-05-23 CN disclosed