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SCHEMBL17417867

SCHEMBL17417867

C=C(C)C(=O)OCCC[SiH2]O[Si](C)(C)O[Si](C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.45
▸ THRB P10828 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.37
▸ POLB P06746 1/20 0.36
▸ APEX1 P27695 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL16490336 0.97 TSHR (0.43) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL2142341 0.88 TSHR (0.45) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL434075 0.88 TSHR (0.50) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL12313567 0.83 TSHR (0.43) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL12002706 0.82 TSHR (0.40) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL9744808 0.82 TSHR (0.47) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL8002867 0.82 TSHR (0.47) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL12002708 0.81 TSHR (0.39) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL16850017 0.81 TSHR (0.49) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL8132195 0.81 TSHR (0.46) 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-9879153-B2 Anti-icing composite WANG LIANG (US) 2018-01-30 — — US disclosed
US-20160009971-A1 Anti-Icing Composite WANG LIANG (US) 2016-01-14 — — US disclosed