SCHEMBL21447962

SCHEMBL21447962

COCCCOC(=O)C(CC(C)(C)F)N(C)C(=O)OC(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CA14 Q9ULX7 1/20 0.32
▸ AAK1 Q2M2I8 2/20 0.31
▸ MMP13 P45452 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
SCHEMBL18248195 0.83 AAK1 (0.36) CA14AAK1MMP13
SCHEMBL18248194 0.83 AAK1 (0.36) CA14AAK1MMP13
SCHEMBL20166246 0.82 NFKB1 (0.35) CA14AAK1MMP13
SCHEMBL19088621 0.78 AAK1 (0.34) CA14AAK1MMP13
SCHEMBL19088491 0.77 AAK1 (0.34) CA14AAK1MMP13
SCHEMBL18248003 0.77 MMP13 (0.37) CA14AAK1MMP13
SCHEMBL18248055 0.77 MMP13 (0.37) CA14AAK1MMP13
SCHEMBL26034208 0.76 AAK1 (0.33) CA14AAK1MMP13
SCHEMBL24093734 0.75 AAK1 (0.33) AAK1MMP13
SCHEMBL30916076 0.75 AAK1 (0.36) CA14AAK1MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11382949-B2 Anthelmintic depsipeptide compounds Boehringer Ingelheim Animal Health USA Inc. (US) 2022-07-12 — — US disclosed
US-20190307838-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS Boehringer Ingelheim Animal Health USA Inc. (US) 2019-10-10 — — 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 (2 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-11382949-B2 Anthelmintic depsipeptide compounds ENPP2, ROCK2, RRP12 CA14 2150/4885AAK1 3576/4885MMP13 1446/4885
US-20190307838-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS ENPP2, ROCK2, RRP12 CA14 2150/4885AAK1 3576/4885MMP13 1446/4885

“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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