SCHEMBL16805960

SCHEMBL16805960

C=CC(=O)OCC(COC(=O)C=C)(COC(=O)C=C)COC(=O)C(=O)OCC(COC(=O)C=C)(COC(=O)C=C)COC(=O)C=C

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.69
HIF1A Q16665 4/20 0.69
TP53 P04637 3/20 0.69
CYP3A4 P08684 2/20 0.69
MAPK1 P28482 2/20 0.69
SMN1; SMN2 Q16637 1/20 0.69
THRB P10828 2/20 0.47
TSHR P16473 7/20 0.46
HSD17B10 Q99714 1/20 0.46
HPGD P15428 1/20 0.42

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
SCHEMBL16806096 0.94 ALDH1A1 (0.62) ALDH1A1HIF1ATP53CYP3A4MAPK1
SCHEMBL101492 0.93 ALDH1A1 (0.78) ALDH1A1HIF1ATP53CYP3A4MAPK1
SCHEMBL16805963 0.90 ALDH1A1 (0.58) ALDH1A1HIF1ATP53CYP3A4MAPK1
SCHEMBL20148970 0.90 ALDH1A1 (0.62) ALDH1A1HIF1ATP53CYP3A4MAPK1
SCHEMBL18808382 0.89 ALDH1A1 (0.56) ALDH1A1HIF1ATP53CYP3A4MAPK1
Butadiene SCHEMBL10409182 0.88 ALDH1A1 (0.72) ALDH1A1HIF1ATP53CYP3A4MAPK1
SCHEMBL19652444 0.86 ALDH1A1 (0.69) ALDH1A1HIF1ATP53CYP3A4MAPK1
SCHEMBL20690222 0.86 ALDH1A1 (0.69) ALDH1A1HIF1ATP53CYP3A4MAPK1
SCHEMBL268293 0.86 ALDH1A1 (0.69) ALDH1A1HIF1ATP53CYP3A4MAPK1
Acrylic Acid SCHEMBL9170386 0.86 ALDH1A1 (0.69) ALDH1A1HIF1ATP53CYP3A4MAPK1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160282718-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA OFFSET BV (BE) 2016-09-29 US disclosed
US-20160282718-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA OFFSET BV (BE) 2016-09-29 US disclosed
WO-2015086659-A1 A LITHOGRAPHIC PRINTING PLATE PRECURSOR AND MONOMER AGFA GRAPHICS NV (BE) 2015-06-18 WO 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-20160282718-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR LOXL1, LOXL2, LOXL3 ALDH1A1 1892/4885HIF1A 2290/4885TP53 2297/4885

“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.