SCHEMBL19244991

SCHEMBL19244991

CN(C(=O)OC(C)(C)C)[C@@H](CCC(C)(C)O)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MMP13 P45452 1/20 0.36
▸ MEN1 O00255 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ AAK1 Q2M2I8 2/20 0.34
▸ HDAC1 Q13547 1/20 0.30
▸ HDAC2 Q92769 1/20 0.30
▸ HDAC6 Q9UBN7 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
SCHEMBL22651558 0.90 MMP13 (0.38) MMP13MEN1GAAKMT2AAAK1
SCHEMBL19245050 0.86 MMP13 (0.36) MMP13MEN1GAAKMT2AAAK1
SCHEMBL21447817 0.84 AAK1 (0.35) MMP13AAK1
SCHEMBL9447853 0.83 MMP13 (0.38) MMP13MEN1GAAKMT2AAAK1
SCHEMBL20586574 0.83 MMP13 (0.38) MMP13MEN1GAAKMT2AAAK1
SCHEMBL66573 0.83 HDAC1 (0.41) MMP13MEN1GAAKMT2AAAK1
SCHEMBL20826464 0.83 HDAC1 (0.41) MMP13MEN1GAAKMT2AAAK1
SCHEMBL18248156 0.83 MMP13 (0.38) MMP13MEN1GAAKMT2AAAK1
SCHEMBL67491 0.83 HDAC1 (0.41) MMP13MEN1GAAKMT2AAAK1
SCHEMBL8906653 0.82 FOLH1 (0.38) MMP13MEN1GAAKMT2AAAK1

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
US-12018048-B2 Anthelmintic depsipeptide compounds Boehringer Ingelheim Animal Health USA Inc. (US) 2024-06-25 — — US disclosed
US-20220098241-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS Boehringer Ingelheim Animal Health USA Inc. (US) 2022-03-31 — — US disclosed
US-20200354408-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS Boehringer Ingelheim Animal Health USA Inc. (US) 2020-11-12 — — US disclosed
US-10344056-B2 Anthelmintic depsipeptide compounds Boehringer Ingelheim Animal Health USA Inc. (US) 2019-07-09 — — US disclosed
US-20170233438-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS MERIAL INC. (US) 2017-08-17 — — 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 (5 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-10344056-B2 Anthelmintic depsipeptide compounds VIP, PREP, DNPEP MMP13 440/4885MEN1 1735/4885GAA 2706/4885
US-12018048-B2 Anthelmintic depsipeptide compounds VIP, DNPEP, DPEP1 MMP13 434/4885MEN1 1915/4885GAA 1692/4885
US-20170233438-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS VIP, PREP, DNPEP MMP13 440/4885MEN1 1735/4885GAA 2706/4885
US-20220098241-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS VIP, PREP, DNPEP MMP13 440/4885MEN1 1735/4885GAA 2706/4885
US-20200354408-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS VIP, PREP, DNPEP MMP13 504/4885MEN1 1902/4885GAA 2604/4885

“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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