SCHEMBL28217128

SCHEMBL28217128

C=CC(=O)OC(CC)C(C)[SiH](OCCC)OCCC

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.38
HPGD P15428 1/20 0.38
ALDH1A1 P00352 3/20 0.30
TP53 P04637 2/20 0.30
HIF1A Q16665 2/20 0.30
CYP3A4 P08684 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL28077582 0.91 TSHR (0.46) TSHRHPGDALDH1A1CYP3A4
SCHEMBL15265381 0.88 TSHR (0.37) TSHRHPGD
SCHEMBL18051042 0.83 TSHR (0.38) TSHRHPGD
SCHEMBL139101 0.80 TSHR (0.41) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL8007977 0.75 TSHR (0.40) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL2046277 0.75 TSHR (0.45) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL23494343 0.73 TSHR (0.44) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL5373230 0.73 TSHR (0.44) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL27816092 0.73 TSHR (0.44) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL23493964 0.72 TSHR (0.42) TSHRHPGDALDH1A1TP53HIF1A

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-104781363-B Water-dispersible adhesive composition for transparent conductive layer, adhesive layer for transparent conductive layer, optical film with adhesive layer, and liquid crystal display device 日东电工株式会社 2018-05-08 CN disclosed