SCHEMBL28328697

SCHEMBL28328697

O=C=NC(CCC(CO)(CO)CO)(N=C=O)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.33
CYP2C19 P33261 1/20 0.30
HIF1A Q16665 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
SCHEMBL2334754 0.84 KIF11 (0.33) KIF11
SCHEMBL5892151 0.77 KCNN4 (0.34) KIF11CYP2C19HIF1A
SCHEMBL18919852 0.76 TAAR1 (0.35) CYP2C19HIF1A
SCHEMBL4640621 0.76 DRD2 (0.37) KIF11CYP2C19HIF1A
SCHEMBL17942152 0.73 KCNN4 (0.36) KIF11CYP2C19HIF1A
SCHEMBL9132729 0.72 EBP (0.39) KIF11
SCHEMBL3923134 0.72 KIF11 (0.34) KIF11CYP2C19HIF1A
SCHEMBL8677524 0.72 MMP9 (0.35) CYP2C19HIF1A
SCHEMBL43324 0.72 CYP1A2 (0.44) KIF11CYP2C19HIF1A
Ethylene Glycol SCHEMBL1014927 0.69 GAA (0.35) CYP2C19HIF1A

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-110509624-A The manufacturing method of laminated body NITTO DENKO CORP 2019-11-29 CN disclosed
CN-110214084-A Method for producing laminate 日东电工株式会社 2019-09-06 CN disclosed