SCHEMBL28848482

SCHEMBL28848482

C=C[Si](OC)(OC)OCCCCOC(=O)C(=C)C

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.51
THRB P10828 1/20 0.41
POLB P06746 1/20 0.40
APEX1 P27695 1/20 0.40
HTT P42858 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 4/20 0.34
CYP3A4 P08684 1/20 0.34
HPGD P15428 1/20 0.32

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
SCHEMBL20567404 0.82 TSHR (0.45) TSHRTHRBPOLBAPEX1HTT
SCHEMBL28266442 0.81 THRB (0.43) TSHRTHRBPOLBAPEX1HTT
SCHEMBL1013984 0.81 TSHR (0.44) TSHRTHRBPOLBAPEX1HTT
SCHEMBL19411012 0.80 TSHR (0.44) TSHRTHRBPOLBAPEX1HTT
SCHEMBL3366378 0.80 TSHR (0.58) TSHRTHRBPOLBAPEX1HTT
SCHEMBL3272522 0.79 TSHR (0.40) TSHRTHRBPOLBAPEX1HTT
SCHEMBL28748438 0.79 TSHR (0.49) TSHRTHRBPOLBAPEX1HTT
SCHEMBL81666 0.79 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT
SCHEMBL8981529 0.79 TSHR (0.42) TSHRTHRBPOLBAPEX1HTT
SCHEMBL6216027 0.77 TSHR (0.44) 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
CN-115124863-A Metal pigment composition 旭化成株式会社 2022-09-30 CN disclosed