SCHEMBL3814600

SCHEMBL3814600

CC(C)(C)OC(=O)NC(CC1CCCC1)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSK P43235 6/20 0.68
CTSS P25774 5/20 0.68
AAK1 Q2M2I8 2/20 0.50
IDO1 P14902 1/20 0.47
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
GRN P28799 1/20 0.46
SORT1 Q99523 1/20 0.46
KMT2A Q03164 1/20 0.44
CPB2 Q96IY4 1/20 0.43
PPARA Q07869 2/20 0.42
PPARG P37231 1/20 0.42
CACNA1B Q00975 1/20 0.42
REN P00797 1/20 0.42
CTSL P07711 1/20 0.42
CTSB P07858 1/20 0.42
ACE P12821 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
SCHEMBL3819388 1.00 CTSK (0.68) CTSKCTSSAAK1IDO1HDAC4
SCHEMBL3814592 1.00 CTSK (0.68) CTSKCTSSAAK1IDO1HDAC4
SCHEMBL9556128 0.98 CTSK (0.70) CTSKCTSSAAK1IDO1HDAC4
SCHEMBL21427220 0.98 CTSK (0.70) CTSKCTSSAAK1IDO1HDAC4
SCHEMBL16946 0.98 CTSK (0.70) CTSKCTSSAAK1IDO1HDAC4
SCHEMBL16945 0.98 CTSK (0.70) CTSKCTSSAAK1IDO1HDAC4
SCHEMBL9742302 0.98 CTSK (0.70) CTSKCTSSAAK1IDO1HDAC4
SCHEMBL21427213 0.98 CTSK (0.70) CTSKCTSSAAK1IDO1HDAC4
SCHEMBL8283416 0.98 CTSK (0.70) CTSKCTSSAAK1IDO1HDAC4
SCHEMBL9742291 0.98 CTSK (0.70) CTSKCTSSAAK1IDO1HDAC4

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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4534524-A1 AMINO ACID ACTIVE ESTER AND SALT THEREOF PeptiDream Inc. (JP) 2025-04-09 EP disclosed
US-20240208992-A1 MACROCYCLES AS CFTR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2024-06-27 US disclosed
US-20240197666-A1 DITERPENOID COMPOUNDS THAT ACT ON PROTEIN KINASE C (PKC) K-GEN THERAPEUTICS, INC. (US) 2024-06-20 US disclosed
US-20240116910-A1 Heterocycles as WIP1 Inhibitors PMV PHARMACEUTICALS, INC. 2024-04-11 US disclosed
EP-4332089-A1 METHOD FOR PREPARING AMINO ACIDS PHILIPPS-UNIVERSITÄT MARBURG (DE) 2024-03-06 EP disclosed
EP-4313095-A1 DITERPENOID COMPOUNDS THAT ACT ON PROTEIN KINASE C (PKC) K-Gen Therapeutics, Inc. (US) 2024-02-07 EP disclosed
EP-4308575-A1 MACROCYCLES AS CFTR MODULATORS Idorsia Pharmaceuticals Ltd (CH) 2024-01-24 EP disclosed
CN-117098544-A Diterpenoid compounds acting on Protein Kinase C (PKC) K-GEN治疗股份有限公司 2023-11-21 CN disclosed
CN-116981672-A Macrocyclic compounds as CFTR modulators 爱杜西亚药品有限公司 2023-10-31 CN disclosed
EP-4114384-A1 METHODS OF INHIBITING SARS-COV-2 REPLICATION AND TREATING CORONAVIRUS DISEASE 2019 Pfizer Inc. (US) 2023-01-11 EP disclosed
WO-2012149102-A1 NOVEL COMPOUNDS AS WIP1 INHIBITORS GLAXOSMITHKLINE LLC (US) 2012-11-01 WO disclosed
EP-1791837-B1 SUBSTITUTED HYDANTOINS FOR THE TREATMENT OF CANCER HOFFMANN LA ROCHE (CH) 2009-08-19 EP disclosed
US-7371869-B2 Substituted hydantoins HOFFMANN-LA ROCHE INC. (US) 2008-05-13 US disclosed
US-20080076824-A1 modified glycinamides: Valine-alphahydroxy-glycinamide CHRONTECH PHARMA AB (SE) 2008-03-27 US disclosed
US-20080076824-A1 modified glycinamides: Valine-alphahydroxy-glycinamide CHRONTECH PHARMA AB (SE) 2008-03-27 US disclosed
US-20060063814-A1 Substituted hydantoins GOODNOW ROBERT A JR 2006-03-23 US disclosed
US-20060052365-A1 Protease inhibitors SMITHKLINE BEECHAM CORPORATION 2006-03-09 US disclosed
EP-1539178-A2 PROTEASE INHIBITORS SmithKline Beecham Corporation (US) 2005-06-15 EP disclosed
WO-2004017911-A2 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-03-04 WO disclosed
US-5128448-A Peptide hormones HOFFMAN-LA ROCHE INC. (US) 1992-07-07 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 (6 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-20080076824-A1 modified glycinamides: Valine-alphahydroxy-glycinamide GALE, ENGASE, UGGT1 CTSK 2645/4885CTSS 1105/4885AAK1 3829/4885
US-20240208992-A1 MACROCYCLES AS CFTR MODULATORS CFTR, PKD1, ARRB1 CTSK 2996/4885CTSS 2999/4885AAK1 2340/4885
US-20060052365-A1 Protease inhibitors CTSS, CTSE, CMA1 CTSK 5/4885CTSS 1/4885AAK1 1482/4885
US-20060063814-A1 Substituted hydantoins HNMT, MAPK6, KYNU CTSK 1629/4885CTSS 1158/4885AAK1 1909/4885
US-20240116910-A1 Heterocycles as WIP1 Inhibitors WAPL, WHR1, G3BP1 CTSK 3237/4885CTSS 3045/4885AAK1 1283/4885
US-20240197666-A1 DITERPENOID COMPOUNDS THAT ACT ON PROTEIN KINASE C (PKC) PRKCA, PRKCB, PRKCI CTSK 1229/4885CTSS 2903/4885AAK1 259/4885

“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.