SCHEMBL26558014

SCHEMBL26558014

COc1ccc(COC[C@H]2OC(=O)[C@@](C)(O)[C@@H]2OCc2ccc(OC)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GJB2 P29033 1/20 0.38
GJA1 P17302 1/20 0.38
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
TLR9 Q9NR96 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
IDO1 P14902 2/20 0.35
AGXT P21549 2/20 0.35
HTT P42858 2/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
POLB P06746 1/20 0.35
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34

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
SCHEMBL26558053 0.90 GLA (0.39) GLANPSR1GJB2GJA1CA1
SCHEMBL26558034 0.88 GLA (0.37) GLANPSR1TLR9KDM4EMAPT
SCHEMBL26558058 0.87 TLR9 (0.35) GLANPSR1GJB2GJA1CA1
SCHEMBL26558027 0.86 PTAFR (0.37) NPSR1GJB2GJA1RAB9A
SCHEMBL26558059 0.86 CA1 (0.34) GLANPSR1GJB2GJA1CA1
SCHEMBL26558064 0.86 GLA (0.34) GLANPSR1GJB2GJA1CA1
SCHEMBL26558037 0.85 GLA (0.35) GLANPSR1TLR9KDM4EMAPT
SCHEMBL26558018 0.85 ALDH1A1 (0.41) NPSR1MAPTHTTSMN1; SMN2NPC1
SCHEMBL23992569 0.84 TOP2A (0.35) GLANPSR1TLR9KDM4EMAPT
SCHEMBL26558038 0.84 GLA (0.34) GLANPSR1TLR9KDM4EMAPT

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 GLA 4062/4885NPSR1 755/4885GJB2 4745/4885

“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.