Sugi Predict

Sugi Predict / Compounds / SCHEMBL6131728

SCHEMBL6131728

SCHEMBL6131728

C=C(C)C(=O)OCCC[Si](C)(OCC)OCC.CCO[Si](CCCS)(OCC)OCC

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.43
▸ THRB P10828 1/20 0.41
▸ POLB P06746 1/20 0.33
▸ APEX1 P27695 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ ALDH1A1 P00352 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
SCHEMBL4361747 0.93 TSHR (0.49) TSHRTHRBPOLBAPEX1HTT
SCHEMBL28076370 0.91 TSHR (0.36) TSHRTHRB
SCHEMBL8188277 0.91 TSHR (0.44) TSHRTHRBPOLBAPEX1HTT
SCHEMBL15675382 0.88 TSHR (0.44) TSHRTHRBPOLBAPEX1HTT
SCHEMBL63717 0.88 TSHR (0.54) TSHRTHRBPOLBAPEX1HTT
SCHEMBL5191072 0.87 TSHR (0.47) TSHRTHRBPOLBAPEX1HTT
Butanone SCHEMBL28158317 0.86 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL28347564 0.86 TSHR (0.53) TSHRTHRBPOLBAPEX1HTT
SCHEMBL25235967 0.86 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT
SCHEMBL37108 0.86 TSHR (0.56) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1568086-A1 SOL-GEL COATINGS FOR SOLAR CELLS The Boeing Company (US) 2005-08-31 — — EP disclosed
WO-2004051755-A1 SOL-GEL COATINGS FOR SOLAR CELLS THE BOEING COMPANY (US) 2004-06-17 — — WO disclosed