SCHEMBL30708243

SCHEMBL30708243

C=C(C)C(=O)OCCCO[Si](OCCOC)(OCCOC)OCCOC

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
THRB P10828 1/20 0.43
POLB P06746 1/20 0.39
APEX1 P27695 1/20 0.39
HTT P42858 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 2/20 0.38

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
SCHEMBL2228744 0.86 TSHR (0.53) TSHRTHRBPOLBAPEX1HTT
SCHEMBL27753211 0.85 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT
SCHEMBL11745747 0.85 TSHR (0.66) TSHRTHRBPOLBAPEX1HTT
SCHEMBL65533 0.84 THRB (0.59) TSHRTHRBPOLBAPEX1HTT
SCHEMBL554127 0.84 TSHR (0.62) TSHRTHRBPOLBAPEX1HTT
SCHEMBL27406725 0.83 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL22345235 0.83 TSHR (0.47) TSHRTHRBPOLBAPEX1HTT
SCHEMBL3366378 0.83 TSHR (0.58) TSHRTHRBPOLBAPEX1HTT
SCHEMBL73425 0.82 TSHR (0.49) TSHRTHRBPOLBAPEX1HTT
SCHEMBL597402 0.81 TSHR (0.51) TSHRTHRBPOLBAPEX1HTT

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-117561385-A Transmission belt 戴科欧洲有限公司 2024-02-13 CN disclosed