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Sugi Predict / Compounds / SCHEMBL11076158

SCHEMBL11076158

SCHEMBL11076158

C=C(C)C(=O)OCCC[Si](O[Si](C)(C)CCCC(=O)OC)([Si](C)(C)O[Si](C)(C)C)[Si](C)(C)O[Si](C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.38
▸ THRB P10828 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ POLB P06746 1/20 0.31
▸ APEX1 P27695 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL11066310 0.89 TSHR (0.38) TSHRTHRBPOLBAPEX1HTT
SCHEMBL11075265 0.88 TSHR (0.41) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL11080244 0.86 TSHR (0.40) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL11072728 0.85 TSHR (0.39) TSHRTHRBALDH1A1LMNAPOLB
SCHEMBL10794969 0.85 TSHR (0.39) TSHRTHRBALDH1A1LMNAPOLB
SCHEMBL10537263 0.85 TSHR (0.47) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL10794945 0.84 TSHR (0.42) TSHRTHRBALDH1A1LMNAPOLB
SCHEMBL11076154 0.83 TSHR (0.33) TSHRALDH1A1LMNA
SCHEMBL11076633 0.83 TSHR (0.41) TSHRTHRBALDH1A1LMNAPOLB
SCHEMBL35511 0.80 TSHR (0.51) TSHRTHRBALDH1A1POLBAPEX1

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
US-4463149-A UNSATURATED POLYSILOXANES POLYMER TECHNOLOGY CORPORATION (US) 1984-07-31 — — US claimed
US-4463149-A UNSATURATED POLYSILOXANES POLYMER TECHNOLOGY CORPORATION (US) 1984-07-31 — — US disclosed