SCHEMBL21046243

SCHEMBL21046243

CC(O)(C(F)F)[C@H](NC(=O)c1ccc(-c2ccc(C(=N)NO)cc2)cc1)C(=O)NO

nearest known ligand 0.49

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 7/20 0.38

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
SCHEMBL21046242 1.00 ANPEP (0.38) ANPEP
SCHEMBL21046241 1.00 ANPEP (0.38) ANPEP
SCHEMBL21082092 0.89 ANPEP (0.40) ANPEP
SCHEMBL19534376 0.88 ADAMTS5 (0.47) ANPEP
SCHEMBL19520702 0.88 ADAMTS5 (0.47) ANPEP
SCHEMBL19520703 0.88 ADAMTS5 (0.47) ANPEP
SCHEMBL254900 0.86 ANPEP (0.39) ANPEP
SCHEMBL19520681 0.80 NPC1 (0.50) ANPEP
SCHEMBL19520682 0.80 NPC1 (0.50) ANPEP
SCHEMBL21046337 0.80 NPC1 (0.50) ANPEP

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4286001-A2 BENZOYLGLYCINE DERIVATIVES AND METHODS OF MAKING AND USING SAME Duke University (US) 2023-12-06 EP disclosed
US-20210206715-A1 Benzoylglycine Derivatives and Methods of Making and Using Same DUKE UNIVERSITY (US) 2021-07-08 US disclosed
US-11034649-B2 Benzoylglycine derivatives and methods of making and using same DUKE UNIVERSITY (US) 2021-06-15 US disclosed
US-10550074-B2 Benzoylglycine derivatives and methods of making and using same DUKE UNIVERSITY (US) 2020-02-04 US disclosed
US-20190169114-A1 Benzoylglycine Derivatives and Methods of Making and Using Same DUKE UNIVERSITY 2019-06-06 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 (4 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-20210206715-A1 Benzoylglycine Derivatives and Methods of Making and Using Same B3GAT3, GLO1, GLMN ANPEP 1118/4885
US-11034649-B2 Benzoylglycine derivatives and methods of making and using same B3GAT3, GLO1, GLMN ANPEP 1118/4885
US-20190169114-A1 Benzoylglycine Derivatives and Methods of Making and Using Same B3GAT3, GLO1, GLMN ANPEP 1118/4885
US-10550074-B2 Benzoylglycine derivatives and methods of making and using same B3GAT3, GLO1, GLMN ANPEP 1118/4885

“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.