SCHEMBL25822505

SCHEMBL25822505

C=CC(=O)OCCOC(=O)COC

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.57
ALDH1A1 P00352 4/20 0.57
TP53 P04637 3/20 0.57
HIF1A Q16665 3/20 0.57
HSD17B10 Q99714 1/20 0.57
CYP3A4 P08684 2/20 0.52
HPGD P15428 1/20 0.52
THRB P10828 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.35
CA2 P00918 1/20 0.33
ATM Q13315 1/20 0.32
DGKA P23743 1/20 0.31
HCAR2 Q8TDS4 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
SCHEMBL17696342 0.83 TSHR (0.57) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL38483 0.83
Acrylic Acid Ethyl Ester SCHEMBL28232621 0.82 TSHR (0.46) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL17119713 0.82 TSHR (0.55) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL4851024 0.82 TSHR (0.55) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL13849622 0.82 TSHR (0.55) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL27990396 0.82 TSHR (0.60) TSHRALDH1A1TP53HIF1AHSD17B10
Ethylene SCHEMBL23130998 0.81 TSHR (0.64) TSHRALDH1A1TP53HIF1AHSD17B10
Ethylene SCHEMBL15417912 0.81 TSHR (0.64) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL15841507 0.81 TSHR (0.64) TSHRALDH1A1TP53HIF1AHSD17B10

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
US-20230212136-A1 CURABLE RESIN COMPOSITION, CURED PRODUCT, DIFFRACTIVE OPTICAL ELEMENT, AND MULTILAYER DIFFRACTIVE OPTICAL ELEMENT FUJIFILM CORPORATION (JP) 2023-07-06 US disclosed
US-20230212136-A1 CURABLE RESIN COMPOSITION, CURED PRODUCT, DIFFRACTIVE OPTICAL ELEMENT, AND MULTILAYER DIFFRACTIVE OPTICAL ELEMENT FUJIFILM CORPORATION (JP) 2023-07-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230212136-A1 CURABLE RESIN COMPOSITION, CURED PRODUCT, DIFFRACTIVE OPTICAL ELEMENT, AND MULTILAYER DIFFRACTIVE OPTICAL ELEMENT TERB1, RER1, LARP1 TSHR 3138/4885ALDH1A1 228/4885TP53 3328/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.