SCHEMBL14586325

SCHEMBL14586325

CNC(=O)CCCOc1cc(OC)c(CNCCOCCOCCNC(=O)OC(C)(C)C)c(OC)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 6/20 0.43
BCHE P06276 2/20 0.39
CNR2 P34972 2/20 0.39
ADRB2 P07550 2/20 0.39
HTR1A P08908 2/20 0.39
CA12 O43570 4/20 0.38
CA1 P00915 4/20 0.38
CA2 P00918 4/20 0.38
CA9 Q16790 4/20 0.38
HDAC1 Q13547 2/20 0.37
HDAC6 Q9UBN7 2/20 0.37
HDAC3 O15379 1/20 0.37
PDCD1 Q15116 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
SUCNR1 Q9BXA5 1/20 0.37

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
SCHEMBL15715802 0.88 CD274 (0.43) CD274BCHECNR2ADRB2HTR1A
SCHEMBL15258425 0.87 CD274 (0.44) CD274BCHECNR2ADRB2HTR1A
SCHEMBL16342025 0.87 CD274 (0.47) CD274BCHECNR2ADRB2HTR1A
SCHEMBL12222536 0.86 CD274 (0.44) CD274BCHECNR2ADRB2HTR1A
SCHEMBL14511687 0.78 ADRB2 (0.40) CD274BCHECNR2ADRB2HTR1A
SCHEMBL13857331 0.74 TAS1R3 (0.45) CD274BCHECNR2ADRB2HTR1A
SCHEMBL13912242 0.72 TDP1 (0.44) BCHECNR2ADRB2HTR1ACA12
SCHEMBL12706029 0.72 TP53 (0.42) BCHECNR2ADRB2HTR1ACA12
SCHEMBL15987190 0.71 TDP1 (0.46) BCHECNR2ADRB2HTR1ACA12
SCHEMBL12515101 0.69 BCHE (0.49) BCHECNR2ADRB2HTR1ACA12

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-20070032408-A1 Novel spacer moiety for poly (ethylene glycol) modified peptide based compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-08 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-20070032408-A1 Novel spacer moiety for poly (ethylene glycol) modified peptide based compounds NGLY1, YWHAZ, PAM CD274 3285/4885BCHE 401/4885CNR2 2580/4885

“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.