SCHEMBL30916082

SCHEMBL30916082

COC(=O)[C@@H](CCC(C)(F)F)N(C)C(=O)OC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ AAK1 Q2M2I8 3/20 0.35
▸ MMP13 P45452 1/20 0.34
▸ CA14 Q9ULX7 3/20 0.34
▸ CTSK P43235 3/20 0.33
▸ CA1 P00915 2/20 0.33
▸ CA2 P00918 2/20 0.33
▸ CA12 O43570 2/20 0.31
▸ ADORA1 P30542 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
SCHEMBL30916078 0.93 AAK1 (0.36) AAK1MMP13CA14CTSKCA1
SCHEMBL24298082 0.91 AAK1 (0.35) AAK1MMP13CA14CTSKCA1
SCHEMBL30916093 0.89 AAK1 (0.33) AAK1MMP13CA14CTSK
SCHEMBL30916086 0.89 AAK1 (0.40) AAK1MMP13
SCHEMBL21447817 0.87 AAK1 (0.35) AAK1MMP13CA14CA1CA2
SCHEMBL30916076 0.85 AAK1 (0.36) AAK1MMP13CA14CTSKCA1
SCHEMBL20309981 0.83 CA1 (0.40) AAK1MMP13CA14CTSKCA1
SCHEMBL30916053 0.82 AAK1 (0.41) AAK1MMP13
SCHEMBL18248195 0.82 AAK1 (0.36) AAK1MMP13CA14CTSKCA1
SCHEMBL18248194 0.82 AAK1 (0.36) AAK1MMP13CA14CTSKCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260098060-A1 MACROCYCLIC CFTR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2026-04-09 — — US disclosed
EP-4587443-A1 MACROCYCLIC CFTR MODULATORS Idorsia Pharmaceuticals Ltd (CH) 2025-07-23 — — EP disclosed
WO-2024056798-A1 MACROCYCLIC CFTR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2024-03-21 — — WO 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-20260098060-A1 MACROCYCLIC CFTR MODULATORS CFTR, CLIC1, ARRB1 AAK1 2966/4885MMP13 4473/4885CA14 4374/4885

“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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