SCHEMBL3374592

SCHEMBL3374592

CC(C)CC(CC=O)NC(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 6/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA7 P43166 1/20 0.49
CTSK P43235 5/20 0.48
CTSL P07711 2/20 0.47
CTSB P07858 1/20 0.47
CTSS P25774 1/20 0.47
CAPN1 P07384 1/20 0.44
CYP2D6 P10635 1/20 0.41
ATM Q13315 1/20 0.41

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
SCHEMBL24387777 1.00 AAK1 (0.49) AAK1CA1CA2CA7CTSK
SCHEMBL31127632 0.88 CTSK (0.54) AAK1CA1CA2CA7CTSK
SCHEMBL19227630 0.86 CA1 (0.58) AAK1CA1CA2CA7CTSK
SCHEMBL29846285 0.86 AAK1 (0.48) AAK1CA1CA2CA7CTSK
SCHEMBL29846381 0.86 AAK1 (0.48) AAK1CA1CA2CA7CTSK
SCHEMBL1722623 0.83 CTSK (0.50) CA1CA2CA7CTSKCTSS
SCHEMBL29955586 0.83 CTSK (0.50) CA1CA2CA7CTSKCTSS
SCHEMBL24387775 0.83 AAK1 (0.46) AAK1CA1CA2CA7CTSK
SCHEMBL21972768 0.82 CTSK (0.49) AAK1CA1CA2CA7CTSK
SCHEMBL8561571 0.81 CA1 (0.53) AAK1CA1CA2CA7CTSK

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-3455234-B1 SECO MACROLIDE COMPOUNDS SELVITA D O O (HR) 2026-04-01 EP disclosed
US-11512096-B2 Seco macrolide compounds SELVITA D.O.O. (HR) 2022-11-29 US disclosed
US-20210198278-A1 SECO MACROLIDE COMPOUNDS SELVITA D.O.O. (HR) 2021-07-01 US disclosed
US-10919910-B2 Seco macrolide compounds FIDELTA D.O.O. (HR) 2021-02-16 US disclosed
WO-2012000608-A2 NOVEL BETA-AMINOALDEHYDE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR CHEMICAL USE AS REACTIVE INTERMEDIATES GLUESENKAMP KARL-HEINZ (DE) 2012-01-05 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 (3 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-20210198278-A1 SECO MACROLIDE COMPOUNDS SEC61B, SEC16A, SEC61A1 AAK1 3633/4885CA1 4884/4885CA2 4864/4885
US-11512096-B2 Seco macrolide compounds SEC61B, SEC16A, SEC61A1 AAK1 3633/4885CA1 4884/4885CA2 4864/4885
US-10919910-B2 Seco macrolide compounds SEC61B, SEC16A, SEC61A1 AAK1 3633/4885CA1 4884/4885CA2 4864/4885

“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.