SCHEMBL28352183

SCHEMBL28352183

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

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.55
THRB P10828 1/20 0.41
ALDH1A1 P00352 3/20 0.40
TDP1 Q9NUW8 2/20 0.38
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
HTT P42858 1/20 0.38
HPGD P15428 1/20 0.36
ATM Q13315 1/20 0.34
HCAR2 Q8TDS4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
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
SCHEMBL759416 0.88 TSHR (0.50) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL16537643 0.83 TSHR (0.55) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL16537956 0.82 TSHR (0.49) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL16537326 0.82 THRB (0.50) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL11583525 0.79 TSHR (0.84) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL14893 0.79 TSHR (0.84) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL19066401 0.79 TSHR (0.84) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL10486292 0.78 TSHR (0.45) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL28355807 0.78 TSHR (0.45) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL16535971 0.78 TSHR (0.51) TSHRTHRBALDH1A1TDP1POLB

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
CN-110621703-B Process for the production of statistical copolymers, latices and use thereof 电化株式会社 2022-08-26 CN disclosed
CN-110621703-A Process for producing statistical copolymer comprising chloroprene monomer units and unsaturated nitrile monomer units, statistical copolymer, latex, and use thereof 电化株式会社 2019-12-27 CN disclosed