SCHEMBL26558018

SCHEMBL26558018

COc1ccc(COC[C@H]2OC(=O)[C@@](C)(O)[C@@H]2OCc2ccc(OC)c(OC)c2)cc1OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
LYPLA1 O75608 2/20 0.41
LYPLA2 O95372 2/20 0.41
ABHD16A O95870 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.39
HTT P42858 3/20 0.38
TSHR P16473 2/20 0.38
GAA P10253 3/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPK1 P28482 3/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
MAP2K1 Q02750 1/20 0.37

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
SCHEMBL26558014 0.85 GLA (0.39) SMN1; SMN2HTTMAPTHPGDNPC1
SCHEMBL26558027 0.81 PTAFR (0.37) ALDH1A1GAAMEN1KMT2ARAB9A
SCHEMBL26558053 0.75 GLA (0.39) ALDH1A1SMN1; SMN2HTTGAAMAPT
SCHEMBL26558058 0.75 TLR9 (0.35) NPSR1
SCHEMBL26558034 0.74 GLA (0.37) ALDH1A1SMN1; SMN2HTTMAPTHPGD
SCHEMBL26558037 0.73 GLA (0.35) ALDH1A1SMN1; SMN2HTTMAPTHPGD
SCHEMBL26558059 0.72 CA1 (0.34) ALDH1A1SMN1; SMN2HTTMEN1HPGD
SCHEMBL26558064 0.72 GLA (0.34) ALDH1A1SMN1; SMN2HTTMAPTHPGD
SCHEMBL23992569 0.70 TOP2A (0.35) ALDH1A1SMN1; SMN2HTTMAPTHPGD
SCHEMBL26558038 0.70 GLA (0.34) ALDH1A1SMN1; SMN2HTTMAPTHPGD

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 ALDH1A1 946/4885LYPLA1 2813/4885LYPLA2 4324/4885

“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.