SCHEMBL26558186

SCHEMBL26558186

CCCCCCCCCCCCCCCCOC(=O)OC[C@H]1OC(=O)[C@@](C)(O)[C@@H]1OC(=O)OCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
ALDH1A1 P00352 3/20 0.42
CYP3A4 P08684 2/20 0.42
MAPK1 P28482 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
NAAA Q02083 2/20 0.39
LMNA P02545 2/20 0.39
TP53 P04637 1/20 0.37
FDFT1 P37268 2/20 0.37
HPSE Q9Y251 1/20 0.37
PTPN1 P18031 2/20 0.36
DAGLA Q9Y4D2 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CETP P11597 3/20 0.36
CDC25B P30305 1/20 0.36

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
SCHEMBL26558168 1.00 TSHR (0.42) TSHRALDH1A1CYP3A4MAPK1L3MBTL1
SCHEMBL26557776 0.91 ALDH1A1 (0.38) ALDH1A1CYP3A4MAPK1L3MBTL1TDP1
SCHEMBL26558697 0.89 ALDH1A1 (0.36) TSHRALDH1A1CYP3A4MAPK1NAAA
SCHEMBL26558133 0.86 NAAA (0.38) TSHRALDH1A1CYP3A4MAPK1NAAA
SCHEMBL26558150 0.86 NAAA (0.38) TSHRALDH1A1CYP3A4MAPK1NAAA
SCHEMBL26558100 0.82 ALDH1A1 (0.36) ALDH1A1NAAA
SCHEMBL26558101 0.81 NAAA (0.36) TSHRALDH1A1CYP3A4MAPK1L3MBTL1
SCHEMBL26558184 0.81 ALDH1A1 (0.32) TSHRALDH1A1CYP3A4LMNAMAPT
SCHEMBL26558167 0.81 ALDH1A1 (0.32) TSHRALDH1A1CYP3A4LMNAMAPT
SCHEMBL26558110 0.81 ALDH1A1 (0.37) TSHRALDH1A1NAAA

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-20230331751-A1 STEREOSELECTIVE MANUFACTURE OF SELECTED PURINE PHOSPHORAMIDATES Atea Pharmaceuticals, Inc. (US) 2023-10-19 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-20230331751-A1 STEREOSELECTIVE MANUFACTURE OF SELECTED PURINE PHOSPHORAMIDATES NUDT1, PNP, ATIC TSHR 3475/4885ALDH1A1 946/4885CYP3A4 1370/4885

“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.