SCHEMBL21465897

SCHEMBL21465897

CC(C)N[C@@H](CNC(=O)NCCN=[N+]=[N-])C(=O)C(C)C

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 1/20 0.32

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
SCHEMBL21465896 0.78 — —
SCHEMBL26759985 0.76 — —
SCHEMBL26192652 0.76 — —
SCHEMBL20980231 0.74 ADRB2 (0.32) —
SCHEMBL20425900 0.70 KMT2A (0.39) —
SCHEMBL20980230 0.69 ALB (0.38) —
SCHEMBL26759929 0.69 MEN1 (0.35) —
SCHEMBL15469217 0.69 CASR (0.37) —
SCHEMBL22314737 0.69 ACHE (0.35) —
SCHEMBL21465911 0.67 CNR2 (0.33) —

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-10442789-B2 Modified amino acids comprising tetrazine functional groups, methods of preparation, and methods of their use SUTRO BIOPHARMA, INC. (US) 2019-10-15 — — 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-10442789-B2 Modified amino acids comprising tetrazine functional groups, methods of preparation, and methods of their use DNPEP, SLC1A5, AADAT EPHX1 3835/4885

“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.

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