SCHEMBL28352181

SCHEMBL28352181

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

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.55
THRB P10828 1/20 0.41
POLB P06746 1/20 0.41
APEX1 P27695 1/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 3/20 0.40
HPGD P15428 2/20 0.36
ATM Q13315 1/20 0.34
LMNA P02545 2/20 0.32
ESR1 P03372 2/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2C19 P33261 2/20 0.32
CYP2D6 P10635 1/20 0.32
MAPK1 P28482 1/20 0.32
NR1H2 P55055 1/20 0.32
RNASEL Q05823 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
RECQL P46063 1/20 0.31
CYP3A4 P08684 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
SCHEMBL16537556 0.88 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL16537586 0.84 TSHR (0.53) TSHRTHRBPOLBAPEX1HTT
SCHEMBL16537640 0.83 TSHR (0.55) TSHRTHRBPOLBAPEX1HTT
SCHEMBL16537954 0.82 TSHR (0.49) TSHRTHRBPOLBAPEX1HTT
SCHEMBL140539 0.81 TSHR (0.57) TSHRTHRBPOLBAPEX1HTT
SCHEMBL29184225 0.80 TSHR (0.59) TSHRTHRBPOLBAPEX1HTT
SCHEMBL28330736 0.80 TSHR (0.62) TSHRTHRBPOLBAPEX1HTT
SCHEMBL22371483 0.79 TSHR (0.58) TSHRTHRBPOLBAPEX1HTT
SCHEMBL28355806 0.79 TSHR (0.46) TSHRTHRBPOLBAPEX1HTT
SCHEMBL29198317 0.79 TSHR (0.60) 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
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