SCHEMBL14539205

SCHEMBL14539205

C/C=C1\OC(=O)C(C)=C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1C

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.43
▸ POLB P06746 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ SLC28A3 Q9HAS3 2/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ TYR P14679 1/20 0.41
▸ EPHX2 P34913 2/20 0.41
▸ CA12 O43570 4/20 0.40
▸ CA9 Q16790 4/20 0.40
▸ CA1 P00915 3/20 0.40
▸ CA7 P43166 1/20 0.40
▸ CA13 Q8N1Q1 1/20 0.40
▸ SLC5A2 P31639 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ SNCA P37840 1/20 0.40

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
SCHEMBL14514180 1.00 ALDH1A1 (0.43) ALDH1A1POLBMEN1KMT2ASLC28A3
SCHEMBL14514179 0.83 ALDH1A1 (0.45) ALDH1A1POLBMEN1KMT2ASLC28A3
SCHEMBL14514178 0.76 ALDH1A1 (0.46) ALDH1A1POLBMEN1KMT2ASLC28A3
SCHEMBL14514189 0.76 ALDH1A1 (0.46) ALDH1A1POLBMEN1KMT2ASLC28A3
SCHEMBL14514190 0.74 ALDH1A1 (0.45) ALDH1A1POLBMEN1KMT2ASLC28A3
SCHEMBL14514176 0.74 ALDH1A1 (0.45) ALDH1A1POLBMEN1KMT2ASLC28A3
SCHEMBL25632421 0.69 POLB (0.49) ALDH1A1POLBMEN1KMT2ASLC28A3
SCHEMBL22882206 0.69 ALDH1A1 (0.49) ALDH1A1POLBMEN1KMT2ASLC28A3
SCHEMBL26601048 0.69 ALDH1A1 (0.49) ALDH1A1POLBMEN1KMT2ASLC28A3
SCHEMBL14514177 0.68 ALDH1A1 (0.49) ALDH1A1POLBMEN1KMT2ASLC28A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070111952-A1 Glycosylated triketide delta lactones UNIVERSITE CATHOLIQUE DE LOUVAIN (BE) 2007-05-17 — — 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-20070111952-A1 Glycosylated triketide delta lactones AGL, AKR1C3, AKR1C4 ALDH1A1 416/4885POLB 4605/4885MEN1 3691/4885

“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.

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