SCHEMBL29151968

SCHEMBL29151968

C=CC(=O)OC(CN=C=O)(OC(=O)C=C)OC(=O)C=C

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.33
TP53 P04637 3/20 0.33
HIF1A Q16665 3/20 0.33
CYP3A4 P08684 2/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TSHR P16473 5/20 0.32
HSD17B10 Q99714 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
SCHEMBL367296 0.81 TSHR (0.32) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL10628799 0.78 THRB (0.34) TSHR
SCHEMBL5163889 0.78 TSHR (0.30) TSHR
Phosphoric Acid SCHEMBL27981628 0.76
SCHEMBL9741117 0.75 CYP3A4 (0.32) CYP3A4TSHR
SCHEMBL7934787 0.74 TSHR (0.43) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL28885916 0.74 ALDH1A1 (0.36) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL28300861 0.72 ALDH1A1 (0.35) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL17264958 0.72 ALDH1A1 (0.44) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL5994368 0.70 ALDH1A1 (0.50) ALDH1A1TP53HIF1ACYP3A4MAPK1

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-117980364-A Curable organopolysiloxane composition, organopolysiloxane adhesive layer obtained by curing the same, and laminate 陶氏东丽株式会社 2024-05-03 CN disclosed
CN-117203280-A Ultraviolet curable composition and use thereof 陶氏东丽株式会社 2023-12-08 CN disclosed