SCHEMBL14030764

SCHEMBL14030764

C[C@H]1C=C(C(=O)O)C(C(=O)O)=C[C@H]1O

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL813574 0.81 TSHR (0.35) ALDH1A1
SCHEMBL813575 0.81 TSHR (0.35) ALDH1A1
SCHEMBL23518933 0.70 POLB (0.34) POLBCTDSP1TDP1
SCHEMBL22360120 0.67
SCHEMBL13064987 0.63
SCHEMBL7112593 0.61 TSHR (0.33) ALDH1A1
SCHEMBL28281117 0.61 TSHR (0.33) ALDH1A1
SCHEMBL13067938 0.61 FUCA1 (0.31) POLBCTDSP1TDP1
SCHEMBL22919828 0.61 NEU2 (0.40) POLBALDH1A1
SCHEMBL21917631 0.59 ALDH1A1 (0.35) POLBTDP1ALDH1A1

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-20080269344-A1 Beta2-Adrenergic Receptor Agonists THERAVANCE BIOPHARMA R&D IP, LLC 2008-10-30 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-20080269344-A1 Beta2-Adrenergic Receptor Agonists ADRB2, ADRB1, ADRA2B POLB 1147/4885CTDSP1 4027/4885TDP1 2274/4885

“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.