SCHEMBL26565841

SCHEMBL26565841

CCOC(=O)OC[C@H]1OC(=O)C(C)(C)[C@@H]1OC(=O)OCC

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 6/20 0.41
ALDH1A1 P00352 6/20 0.41
CYP3A4 P08684 6/20 0.41
CYP2C9 P11712 4/20 0.41
HSD17B10 Q99714 2/20 0.39
MAPK1 P28482 1/20 0.39
MAPT P10636 3/20 0.37
TSHR P16473 1/20 0.36
CYP2D6 P10635 1/20 0.35
SOAT1 P35610 1/20 0.32
LMNA P02545 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
KDM4E B2RXH2 1/20 0.30
GLA P06280 1/20 0.30
ATM Q13315 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
SCHEMBL26558434 0.86 CYP2C19 (0.39) CYP2C19ALDH1A1CYP3A4CYP2C9HSD17B10
SCHEMBL26565832 0.84 SMN1; SMN2 (0.33)
SCHEMBL26565858 0.81
SCHEMBL26558697 0.74 ALDH1A1 (0.36) CYP2C19ALDH1A1CYP3A4MAPK1MAPT
SCHEMBL26558447 0.72 ALDH1A1 (0.35) CYP2C19ALDH1A1CYP3A4MAPK1MAPT
SCHEMBL26557819 0.71 SMN1; SMN2 (0.33)
SCHEMBL26557816 0.70 SMN1; SMN2 (0.32)
SCHEMBL7871495 0.69 ALDH1A1 (0.45) CYP2C19ALDH1A1CYP3A4CYP2C9HSD17B10
SCHEMBL26558079 0.69
SCHEMBL11203457 0.64 ALDH1A1 (0.41) CYP2C19ALDH1A1CYP3A4CYP2C9HSD17B10

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 CYP2C19 1262/4885ALDH1A1 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.