SCHEMBL21726166

SCHEMBL21726166

CC1(C)OC(=O)[C@H](CO)O1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GLS O94925 1/20 0.40
GLA P06280 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PTPN1 P18031 1/20 0.30
BACE1 P56817 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
SCHEMBL21726165 1.00 GLS (0.40) GLSGLANPSR1PTPN1BACE1
SCHEMBL9196022 1.00 GLS (0.40) GLSGLANPSR1PTPN1BACE1
SCHEMBL2158180 0.85 GLS (0.40) GLSGLANPSR1
SCHEMBL184053 0.85 GLS (0.40) GLSGLANPSR1
SCHEMBL184052 0.85 GLS (0.40) GLSGLANPSR1
SCHEMBL12372230 0.80 GLS (0.38) GLSGLANPSR1
SCHEMBL21726164 0.80 GLS (0.38) GLSGLANPSR1
SCHEMBL264858 0.80 GLS (0.38) GLSGLANPSR1
SCHEMBL1005092 0.78 GLS (0.47) GLSBACE1
SCHEMBL200462 0.78 GLS (0.47) GLSBACE1

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-10561661-B2 Purine derivative compounds for medical use MANROS THERAPEUTICS (FR) 2020-02-18 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-10561661-B2 Purine derivative compounds for medical use MSR1, TPMT, M6PR GLS 617/4885GLA 3324/4885NPSR1 578/4885

“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.