SCHEMBL8900490

SCHEMBL8900490

C=C(C)C(=O)OCCC[Si](C)(CCCOC(=O)C(=C)C)OCCC

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.57
THRB P10828 1/20 0.46
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 3/20 0.37
HPGD P15428 1/20 0.33
ACHE P22303 6/20 0.31
ATM Q13315 1/20 0.31
NAAA Q02083 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
SCHEMBL8899367 0.92 TSHR (0.60) TSHRTHRBPOLBAPEX1HTT
SCHEMBL8898984 0.89 TSHR (0.54) TSHRTHRBPOLBAPEX1HTT
SCHEMBL16536381 0.88 TSHR (0.54) TSHRTHRBPOLBAPEX1HTT
SCHEMBL3120535 0.87 TSHR (0.57) TSHRTHRBPOLBAPEX1HTT
SCHEMBL1070990 0.87 TSHR (0.57) TSHRTHRBPOLBAPEX1HTT
SCHEMBL72841 0.85 TSHR (0.59) TSHRTHRBPOLBAPEX1HTT
SCHEMBL8899379 0.85 TSHR (0.59) TSHRTHRBPOLBAPEX1HTT
SCHEMBL25812313 0.83 TSHR (0.53) TSHRTHRBPOLBAPEX1HTT
SCHEMBL16537268 0.83 TSHR (0.57) TSHRTHRBPOLBAPEX1HTT
SCHEMBL16537063 0.83 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5700874-A CONJUGATED DIENE/VINYLAROMATIC HYDROCARBON COPOLYMER MODIFIED WITH ALKOXYSILANE BRIDGESTONE CORPORATION (JP) 1997-12-23 US disclosed