SCHEMBL27029323

SCHEMBL27029323

CN(C(=O)OC(C)(C)C)C1(C)COCCC1=O

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ASGR1 P07306 1/20 0.33
▸ CTSD P07339 1/20 0.32
▸ CTSL P07711 1/20 0.32
▸ CTSB P07858 1/20 0.32
▸ CTSS P25774 1/20 0.32
▸ MT-CO2 P00403 1/20 0.32
▸ GAA P10253 1/20 0.31
▸ USP2 O75604 1/20 0.30
▸ SMN1; SMN2 Q16637 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
SCHEMBL27029254 0.70 GAA (0.40) GAAUSP2SMN1; SMN2
SCHEMBL24204205 0.69 MT-CO2 (0.35) ASGR1MT-CO2GAA
SCHEMBL30097101 0.69 ASGR1 (0.36) ASGR1CTSDCTSLCTSBCTSS
SCHEMBL24937070 0.67 USP2 (0.36) ASGR1CTSDCTSLCTSBCTSS
SCHEMBL24937071 0.67 USP2 (0.36) ASGR1CTSDCTSLCTSBCTSS
SCHEMBL25075599 0.67 HDAC6 (0.33) ASGR1CTSDCTSLCTSBCTSS
SCHEMBL15218843 0.67 USP2 (0.34) ASGR1CTSDCTSLCTSBCTSS
SCHEMBL24204242 0.67 — —
SCHEMBL2745088 0.66 MT-CO2 (0.33) ASGR1MT-CO2
SCHEMBL31509831 0.65 ASGR1 (0.45) ASGR1CTSDCTSLCTSBCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4574214-A2 CYCLIC COMPOUNDS AND METHODS OF USING SAME Schrödinger, Inc. (US) 2025-06-25 — — EP disclosed
EP-4308573-B1 CYCLIC COMPOUNDS AND METHODS OF USING SAME SCHROEDINGER INC (US) 2025-05-07 — — EP disclosed
US-20240199634-A1 CYCLIC COMPOUNDS AND METHODS OF USING SAME SCHRÖDINGER, INC. 2024-06-20 — — US disclosed
EP-4308573-A1 CYCLIC COMPOUNDS AND METHODS OF USING SAME Schrödinger, Inc. (US) 2024-01-24 — — EP disclosed
CN-117120447-A Cyclic compounds and methods of use thereof 薛定谔公司 2023-11-24 — — CN disclosed
WO-2022197898-A1 CYCLIC COMPOUNDS AND METHODS OF USING SAME SCHRÖDINGER, INC. (US) 2022-09-22 — — 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-20240199634-A1 CYCLIC COMPOUNDS AND METHODS OF USING SAME PLK1, DCK, CSNK1A1 ASGR1 2411/4885CTSD 2316/4885CTSL 1474/4885

“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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