SCHEMBL1395771

SCHEMBL1395771

C=C(OCC)OCC(CC)(CO)CO

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HIF1A Q16665 1/20 0.35
THRB P10828 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
SCHEMBL1476339 0.78 ALDH1A1 (0.33) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL4583431 0.77 ALDH1A1 (0.39) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL388497 0.74
SCHEMBL30451 0.72 THRB (0.44) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
Ethylene Glycol SCHEMBL11381651 0.71 ALDH1A1 (0.38) ALDH1A1THRB
Hydrochloric Acid SCHEMBL28031350 0.71 ALDH1A1 (0.42) ALDH1A1THRB
SCHEMBL2637971 0.71 THRB (0.43) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL10637666 0.71 MEN1 (0.41) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL5264945 0.71 THRB (0.43) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL11805516 0.71 ALDH1A1 (0.40) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2

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
EP-2289953-B1 MULTIFUNCTIONAL VINYL ETHER AND RESIN COMPOSITION CONTAINING SAME NIPPON CARBIDE KOGYO KK (JP) 2014-12-03 EP disclosed
US-20110065852-A1 POLYFUNCTIONAL VINYL ETHER AND RESIN COMPOSITION CONTAINING SAME NIPPON CARBIDE INDUSTRIES CO., INC. (JP) 2011-03-17 US disclosed
EP-2289953-A1 MULTIFUNCTIONAL VINYL ETHER AND RESIN COMPOSITION CONTAINING SAME Nippon Carbide Industries Co., Inc. (JP) 2011-03-02 EP 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-20110065852-A1 POLYFUNCTIONAL VINYL ETHER AND RESIN COMPOSITION CONTAINING SAME MLLT1, ILK, DOT1L ALDH1A1 389/4885TP53 2769/4885CYP3A4 1073/4885

“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.