SCHEMBL13847339

SCHEMBL13847339

COC(=O)CCC(CC(=O)OC)NCCCNC(=O)CCCOc1ccc(/C=C2\SC(=O)NC2=O)c2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.40
MEN1 O00255 5/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 2/20 0.40
GAA P10253 1/20 0.40
PLA2G1B P04054 1/20 0.38
HSP90AA1 P07900 1/20 0.38
ATG4B Q9Y4P1 1/20 0.38
KDM4E B2RXH2 2/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 11/20 0.38
IGF1R P08069 2/20 0.38
CYP3A4 P08684 1/20 0.37
ESRRA P11474 1/20 0.37
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
TTR P02766 1/20 0.36
BLM P54132 1/20 0.36

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
SCHEMBL4107574 1.00 KMT2A (0.40) KMT2AMEN1SMN1; SMN2ALDH1A1GAA
SCHEMBL4107569 1.00 KMT2A (0.40) KMT2AMEN1SMN1; SMN2ALDH1A1GAA
SCHEMBL4106780 0.90 MEN1 (0.42) KMT2AMEN1SMN1; SMN2ALDH1A1GAA
SCHEMBL4106787 0.90 MEN1 (0.42) KMT2AMEN1SMN1; SMN2ALDH1A1GAA
SCHEMBL13847342 0.90 MEN1 (0.42) KMT2AMEN1SMN1; SMN2ALDH1A1GAA
SCHEMBL4107586 0.89 HPGD (0.41) KMT2AMEN1SMN1; SMN2ALDH1A1GAA
SCHEMBL12892318 0.82 MEN1 (0.48) KMT2AMEN1SMN1; SMN2ALDH1A1GAA
SCHEMBL1248238 0.82 MEN1 (0.48) KMT2AMEN1SMN1; SMN2ALDH1A1GAA
SCHEMBL1248237 0.82 MEN1 (0.48) KMT2AMEN1SMN1; SMN2ALDH1A1GAA
SCHEMBL12892118 0.82 MEN1 (0.47) KMT2AMEN1SMN1; SMN2ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand NOVO NORDISK A/S (DK) 2009-05-14 US disclosed
US-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand NOVO NORDISK A/S (DK) 2009-05-14 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-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand IAPP, IRS1, HBB KMT2A 4327/4885MEN1 912/4885SMN1; SMN2 2958/4885

“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.