SCHEMBL8899367

SCHEMBL8899367

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

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.60
THRB P10828 1/20 0.45
ALDH1A1 P00352 2/20 0.43
POLB P06746 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
APEX1 P27695 1/20 0.40
HTT P42858 1/20 0.40
HPGD P15428 1/20 0.39
ATM Q13315 1/20 0.37
ACHE P22303 6/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
XDH P47989 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL8900490 0.92 TSHR (0.57) TSHRTHRBALDH1A1POLBTDP1
SCHEMBL3503924 0.88 TSHR (0.60) TSHRTHRBALDH1A1POLBTDP1
SCHEMBL140538 0.88 TSHR (0.60) TSHRTHRBALDH1A1POLBTDP1
SCHEMBL8898984 0.87 TSHR (0.54) TSHRTHRBALDH1A1POLBTDP1
SCHEMBL16536381 0.86 TSHR (0.54) TSHRTHRBALDH1A1POLBTDP1
SCHEMBL72364 0.86 TSHR (0.62) TSHRTHRBALDH1A1POLBTDP1
SCHEMBL8924216 0.86 TSHR (0.62) TSHRTHRBALDH1A1POLBTDP1
SCHEMBL8900512 0.86 TSHR (0.62) TSHRTHRBALDH1A1POLBTDP1
SCHEMBL7710883 0.84 TSHR (0.55) TSHRTHRBALDH1A1POLBTDP1
SCHEMBL1269736 0.83 TSHR (0.58) TSHRTHRBALDH1A1POLBTDP1

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