SCHEMBL5500993

SCHEMBL5500993

CC(C)(C)OC(=O)N(CC=O)ON1C(=O)CCC1=O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.33
MT-CO2 P00403 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31

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
SCHEMBL7106544 0.77 HDAC6 (0.36) HDAC6NFKB1NFKB2RELAHDAC1
SCHEMBL15488438 0.71 HDAC6 (0.37) HDAC6NFKB1NFKB2RELAHDAC1
SCHEMBL27331623 0.69 MT-CO2 (0.35) HDAC6MT-CO2NFKB1NFKB2RELA
SCHEMBL4815974 0.69 MT-CO2 (0.33) HDAC6MT-CO2NFKB1NFKB2RELA
SCHEMBL111602 0.68 CA14 (0.40) HDAC6NFKB1NFKB2RELAHDAC1
SCHEMBL4693101 0.68 HDAC6 (0.39) HDAC6NFKB1NFKB2RELAHDAC1
SCHEMBL4595993 0.68 CTSD (0.32) HDAC6MT-CO2NFKB1NFKB2RELA
SCHEMBL20668140 0.67 MT-CO2 (0.33) MT-CO2NFKB1NFKB2RELA
SCHEMBL23901170 0.67 CA14 (0.36) HDAC6MT-CO2NFKB1NFKB2RELA
SCHEMBL2578067 0.67 CA14 (0.33) HDAC6MT-CO2NFKB1NFKB2RELA

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
EP-1556389-B9 CEPHEM COMPOUNDS ASTELLAS PHARMA INC (JP) 2015-09-09 EP disclosed
EP-1556389-B3 CEPHEM COMPOUNDS ASTELLAS PHARMA INC (JP) 2015-04-01 EP disclosed
EP-1556389-B1 CEPHEM COMPOUNDS ASTELLAS PHARMA INC (JP) 2007-07-25 EP disclosed
US-20070037786-A1 Cephem compounds WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 2007-02-15 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 (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-20070037786-A1 Cephem compounds CEP170, ABCB11, SLC7A1 HDAC6 2950/4885MT-CO2 1564/4885NFKB1 2553/4885

“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.