SCHEMBL16592000

SCHEMBL16592000

CCC(=O)CNC(=O)CCC(C)=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
TDP1 Q9NUW8 3/20 0.38
RECQL P46063 2/20 0.38
GAA P10253 1/20 0.37
LMNA P02545 1/20 0.37
SLC15A2 Q16348 1/20 0.37
FAAH O00519 6/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
CASP2 P42575 1/20 0.32
KDM4E B2RXH2 2/20 0.32
KDM6B O15054 1/20 0.32
KDM5C P41229 1/20 0.32
EGLN1 Q9GZT9 1/20 0.32
PHF8 Q9UPP1 1/20 0.32
KDM2A Q9Y2K7 1/20 0.32
USP2 O75604 1/20 0.32
POLB P06746 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL16217882 0.88 RECQL (0.48) ALDH1A1TDP1RECQLGAAFAAH
SCHEMBL17235914 0.86 TDP1 (0.41) ALDH1A1TDP1RECQLGAAFAAH
SCHEMBL16217796 0.83 RECQL (0.48) ALDH1A1TDP1RECQLGAAFAAH
SCHEMBL16217761 0.83 ALDH1A1 (0.38) ALDH1A1TDP1RECQLGAAFAAH
SCHEMBL17235958 0.82 RECQL (0.56) ALDH1A1TDP1RECQLGAAFAAH
SCHEMBL16217889 0.81 ALDH1A1 (0.53) ALDH1A1TDP1RECQLGAALMNA
SCHEMBL24103142 0.81 ALDH1A1 (0.42) ALDH1A1TDP1GAALMNASLC15A2
SCHEMBL12313471 0.80 GAA (0.33) ALDH1A1TDP1RECQLGAAFAAH
SCHEMBL12313037 0.79 FAAH (0.33) ALDH1A1TDP1RECQLGAAFAAH
SCHEMBL8533512 0.79 MEN1 (0.52) ALDH1A1TDP1RECQLGAALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017192820-A1 GLP-1 RECEPTOR LIGAND MOIETY CONJUGATED OLIGONUCLEOTIDES AND USES THEREOF IONIS PHARMACEUTICALS, INC. (US) 2017-11-09 WO disclosed
US-20170305956-A1 Ligand-Modified Double-Stranded Nucleic Acids NOVO NORDISK A/S (DK) 2017-10-26 US disclosed
WO-2015042447-A1 TARGETED THERAPEUTIC NUCLEOSIDES AND THEIR USE ISIS PHARMACEUTICALS, INC. (US) 2015-03-26 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 (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-20170305956-A1 Ligand-Modified Double-Stranded Nucleic Acids ADAR, NCL, SSU72 ALDH1A1 3796/4885TDP1 985/4885RECQL 1015/4885

“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.