SCHEMBL20905929

SCHEMBL20905929

CC(C)(C)OC(=O)N[C@@H](Cc1cccc(O)c1)C(=O)OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSS P25774 7/20 0.56
CTSK P43235 5/20 0.56
CTSB P07858 4/20 0.56
ACE P12821 1/20 0.55
CTSL P07711 2/20 0.54
KLK5 Q9Y337 1/20 0.53
PPARA Q07869 1/20 0.53
TACR1 P25103 2/20 0.52
POLB P06746 2/20 0.51
EPHX2 P34913 1/20 0.50
SYK P43405 1/20 0.50
TYR P14679 1/20 0.50
MAPT P10636 1/20 0.49
MAPK1 P28482 1/20 0.49

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
SCHEMBL14576685 1.00 CTSS (0.56) CTSSCTSKCTSBACECTSL
SCHEMBL30051055 1.00 CTSS (0.56) CTSSCTSKCTSBACECTSL
SCHEMBL15856094 0.90 CTSS (0.55) CTSSCTSKCTSBACECTSL
SCHEMBL15856124 0.90 CTSS (0.55) CTSSCTSKCTSBACECTSL
SCHEMBL3355326 0.90 CTSS (0.64) CTSSCTSKCTSBACECTSL
SCHEMBL85543 0.90 CTSS (0.64) CTSSCTSKCTSBACECTSL
SCHEMBL22404737 0.90 CTSS (0.64) CTSSCTSKCTSBACECTSL
SCHEMBL12643835 0.89 CTSS (0.52) CTSSCTSKCTSBACECTSL
SCHEMBL2352336 0.89 KLK5 (0.59) CTSSCTSKCTSBACECTSL
SCHEMBL6491302 0.89 KLK5 (0.59) CTSSCTSKCTSBACECTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11834515-B2 Macrocyclic compounds as proteasome inhibitors CORNELL UNIVERSITY (US) 2023-12-05 US disclosed
US-20230287021-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR STABILIZING TRANSTHYRETIN AND INHIBITING TRANSTHYRETIN MISFOLDING PROTEGO BIOPHARMA, INC. 2023-09-14 US disclosed
US-11014963-B2 Trifluoromethylpropanamide derivatives as HTRA1 inhibitors HOFFMANN-LA ROCHE INC. (US) 2021-05-25 US disclosed
WO-2019075259-A1 MACROCYCLIC COMPOUNDS AS PROTEASOME INHIBITORS CORNELL UNIVERSITY (US) 2019-04-18 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-20230287021-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR STABILIZING TRANSTHYRETIN AND INHIBITING TRANSTHYRETIN MISFOLDING TTR, TTPA, TNNC1 CTSS 468/4885CTSK 1005/4885CTSB 803/4885
US-11014963-B2 Trifluoromethylpropanamide derivatives as HTRA1 inhibitors HTRA1, HTR3E, HTR1F CTSS 1204/4885CTSK 1544/4885CTSB 1041/4885
US-11834515-B2 Macrocyclic compounds as proteasome inhibitors PSMB5, PSMB1, PSMB3 CTSS 640/4885CTSK 1101/4885CTSB 466/4885

“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.