SCHEMBL16620476

SCHEMBL16620476

CC(C)C[C@H](NCC(=O)NC(=O)c1cc(Cl)ccc1Cl)B(O)O

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 18/20 0.73
PSMB8 P28062 5/20 0.73
PSMB9 P28065 5/20 0.73
PSMB6 P28072 5/20 0.73
PSMB10 P40306 5/20 0.73
PSMB11 A5LHX3 4/20 0.73
PSMA7 O14818 4/20 0.73
PSMB1 P20618 4/20 0.73
PSMA1 P25786 4/20 0.73
PSMA2 P25787 4/20 0.73
PSMA3 P25788 4/20 0.73
PSMA4 P25789 4/20 0.73
PSMA5 P28066 4/20 0.73
PSMB4 P28070 4/20 0.73
PSMB3 P49720 4/20 0.73
PSMB2 P49721 4/20 0.73
PSMA6 P60900 4/20 0.73
PSMA8 Q8TAA3 4/20 0.73
PSMB7 Q99436 4/20 0.73
NFKB1 P19838 1/20 0.73

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
Ixazomib SCHEMBL29353014 0.85 PSMB5 (1.00) PSMB5PSMB8PSMB9PSMB6PSMB10
Ixazomib SCHEMBL3742758 0.85 PSMB5 (1.00) PSMB5PSMB8PSMB9PSMB6PSMB10
Ixazomib SCHEMBL18088836 0.85 PSMB5 (1.00) PSMB5PSMB8PSMB9PSMB6PSMB10
SCHEMBL28826826 0.83 PSMB5 (0.82) PSMB5PSMB8PSMB9PSMB6PSMB10
SCHEMBL28826825 0.83 PSMB5 (0.82) PSMB5PSMB8PSMB9PSMB6PSMB10
Ixazomib SCHEMBL29454797 0.82 PSMB5 (0.81) PSMB5PSMB8PSMB9PSMB6PSMB10
SCHEMBL12391076 0.79 PSMB5 (0.84) PSMB5PSMB8PSMB9PSMB6PSMB10
SCHEMBL23641263 0.78 PSMB5 (0.81) PSMB5PSMB8PSMB9PSMB6PSMB10
SCHEMBL3753435 0.77 PSMB5 (0.85) PSMB5PSMB8PSMB9PSMB6PSMB10
SCHEMBL24224218 0.77 PSMB5 (0.67) PSMB5PSMB8PSMB9PSMB6PSMB10

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-20180099000-A1 Method for the Prophylaxis or Treatment of Systemic Lupus Erythematosus and/or Lupus Nephritis MILLENNIUM PHARM INC (US) 2018-04-12 US disclosed
US-20160250238-A1 Method for the Prophylaxis or Treatment of Systemic Lupus Erythematosus and/or Lupus Nephritis MILLENNIUM PHARMACEUTICALS, INC. (US) 2016-09-01 US disclosed
EP-3052105-A1 METHOD FOR THE PROPHYLAXIS OR TREATMENT OF SYSTEMIC LUPUS ERYTHEMATOSUS AND/OR LUPUS NEPHRITIS Millennium Pharmaceuticals, Inc. (US) 2016-08-10 EP disclosed
WO-2015051067-A1 METHOD FOR THE PROPHYLAXIS OR TREATMENT OF SYSTEMIC LUPUS ERYTHEMATOSUS AND/OR LUPUS NEPHRITIS MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-04-09 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 (2 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-20160250238-A1 Method for the Prophylaxis or Treatment of Systemic Lupus Erythematosus and/or Lupus Nephritis SSB, ME1, SLC16A1 PSMB5 2121/4885PSMB8 2379/4885PSMB9 2129/4885
US-20180099000-A1 Method for the Prophylaxis or Treatment of Systemic Lupus Erythematosus and/or Lupus Nephritis SSB, ME1, SLC16A1 PSMB5 1893/4885PSMB8 2293/4885PSMB9 2005/4885

“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.