SCHEMBL27100711

SCHEMBL27100711

COC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CN1C(C)=O

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 14/20 0.56
ANPEP P15144 9/20 0.54
BTK Q06187 1/20 0.46
CTSK P43235 2/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CYP2C9 P11712 1/20 0.39
HSD11B1 P28845 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL7727313 0.89 BTK (0.46) MMP2ANPEPBTKCTSKCA1
SCHEMBL22506037 0.89 BTK (0.49) MMP2ANPEPBTKCTSKCA1
SCHEMBL7727315 0.89 BTK (0.46) MMP2ANPEPBTKCTSKCA1
SCHEMBL7731684 0.89 BTK (0.46) MMP2ANPEPBTKCTSKCA1
SCHEMBL854269 0.88 BTK (0.45) MMP2ANPEPBTKCTSKCA1
SCHEMBL30422379 0.85 BTK (0.43) MMP2ANPEPBTKCTSKCA1
SCHEMBL13938227 0.81 MMP2 (0.47) MMP2ANPEPALDH1A1
SCHEMBL13938226 0.81 MMP2 (0.47) MMP2ANPEPALDH1A1
SCHEMBL10085244 0.80 BTK (0.38) MMP2ANPEPBTKCTSKCA1
SCHEMBL7722111 0.80 BTK (0.38) MMP2ANPEPBTKCTSKCA1

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-11912727-B2 Arginase inhibitors and methods of use thereof ASTRAZENECA AB (SE) 2024-02-27 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-11912727-B2 Arginase inhibitors and methods of use thereof ARG1, ARG2, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 MMP2 999/4885ANPEP 1703/4885BTK 3785/4885

“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.