SCHEMBL23901170

SCHEMBL23901170

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

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA14 Q9ULX7 1/20 0.36
HDAC6 Q9UBN7 2/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
PSMB8 P28062 2/20 0.32
PSMB5 P28074 1/20 0.32
MT-CO2 P00403 1/20 0.32
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
SSTR4 P31391 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
SCHEMBL329892 0.89 CA14 (0.41) CA14HDAC6HDAC1HDAC2
SCHEMBL16995537 0.89 CA14 (0.38) CA14
SCHEMBL20160218 0.88 CA14 (0.30) CA14
SCHEMBL16092585 0.87 HDAC6 (0.33) HDAC6HDAC1HDAC2PSMB8PSMB5
SCHEMBL2578067 0.86 CA14 (0.33) CA14HDAC6HDAC1HDAC2MT-CO2
SCHEMBL4815974 0.85 MT-CO2 (0.33) CA14HDAC6HDAC1HDAC2MT-CO2
SCHEMBL25942207 0.85 CA14 (0.38) CA14
SCHEMBL3728910 0.84 EPHX2 (0.39) CA14HDAC6HDAC1HDAC2
SCHEMBL16092920 0.82 HDAC6 (0.34) HDAC6HDAC1HDAC2MT-CO2
SCHEMBL8740492 0.82 STING1 (0.34) PSMB8PSMB5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210308277-A1 CONJUGATION LINKERS, CELL BINDING MOLECULE-DRUG CONJUGATES CONTAINING THE LINKERS, METHODS OF MAKING AND USES SUCH CONJUGATES WITH THE LINKERS HANGZHOU DAC BIOTECH CO., LTD. (CN) 2021-10-07 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 (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-20210308277-A1 CONJUGATION LINKERS, CELL BINDING MOLECULE-DRUG CONJUGATES CONTAINING THE LINKERS, METHODS OF MAKING AND USES SUCH CONJUGATES WITH THE LINKERS CD2BP2, DCLRE1A, EPCAM CA14 778/4885HDAC6 268/4885HDAC1 1347/4885

“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.