SCHEMBL14902198

SCHEMBL14902198

CC(=O)CC(=O)N1CCC(C(C)=O)CC1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
NPC1 O15118 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.38
HTT P42858 1/20 0.38
EPHX2 P34913 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
PTPN1 P18031 1/20 0.37
GAA P10253 2/20 0.37
LMNA P02545 1/20 0.37
YAP1 P46937 1/20 0.36
TEAD4 Q15561 1/20 0.36
MEN1 O00255 1/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 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
SCHEMBL14902196 0.86 LMNA (0.51) ALDH1A1NPC1SMN1; SMN2L3MBTL1GAA
SCHEMBL17812266 0.84 CPN1 (0.47) ALDH1A1NPC1SMN1; SMN2L3MBTL1GAA
SCHEMBL22051142 0.83 ALDH1A1 (0.44) ALDH1A1NPC1SMN1; SMN2HTTL3MBTL1
SCHEMBL14902197 0.83 ALDH1A1 (0.59) ALDH1A1NPC1SMN1; SMN2HTTL3MBTL1
SCHEMBL12128698 0.82 ALDH1A1 (0.62) ALDH1A1NPC1SMN1; SMN2L3MBTL1LMNA
SCHEMBL2413139 0.82 ALDH1A1 (0.42) ALDH1A1NPC1HTTEPHX2MEN1
SCHEMBL12436034 0.82 ALDH1A1 (0.42) ALDH1A1NPC1SMN1; SMN2L3MBTL1GAA
SCHEMBL12436953 0.82 EPHX2 (0.50) ALDH1A1NPC1EPHX2GAA
SCHEMBL13429460 0.80 ALDH1A1 (0.44) ALDH1A1NPC1SMN1; SMN2HTTL3MBTL1
SCHEMBL14890472 0.80 ALDH1A1 (0.41) ALDH1A1NPC1HTTEPHX2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9943498-B2 Fe(III) complex compounds for the treatment and prophylaxis of iron deficiency symptoms and iron deficiency anemias VIFOR (INTERNATIONAL) AG (CH) 2018-04-17 US disclosed
US-9943498-B2 Fe(III) complex compounds for the treatment and prophylaxis of iron deficiency symptoms and iron deficiency anemias VIFOR (INTERNATIONAL) AG (CH) 2018-04-17 US disclosed
US-20160310459-A1 Fe(III) Complex Compounds For The Treatment And Prophylaxis Of Iron Deficiency Symptoms And Iron Deficiency Anemias VIFOR (INTERNATIONAL) AG (CH) 2016-10-27 US disclosed
US-20160310459-A1 Fe(III) Complex Compounds For The Treatment And Prophylaxis Of Iron Deficiency Symptoms And Iron Deficiency Anemias VIFOR (INTERNATIONAL) AG (CH) 2016-10-27 US disclosed
US-9394324-B2 Fe(III) complex compounds for the treatment and prophylaxis of iron deficiency symptoms and iron deficiency anemias VIFOR (INTERNATIONAL) AG (CH) 2016-07-19 US disclosed
US-9394324-B2 Fe(III) complex compounds for the treatment and prophylaxis of iron deficiency symptoms and iron deficiency anemias VIFOR (INTERNATIONAL) AG (CH) 2016-07-19 US disclosed
US-20130109662-A1 Fe(III) Complex Compounds For The Treatment And Prophylaxis Of Iron Deficiency Symptoms And Iron Deficiency Anemias VIFOR (INTERNATIONAL) AG (CH) 2013-05-02 US disclosed
US-20130109662-A1 Fe(III) Complex Compounds For The Treatment And Prophylaxis Of Iron Deficiency Symptoms And Iron Deficiency Anemias VIFOR (INTERNATIONAL) AG (CH) 2013-05-02 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 (2 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-20130109662-A1 Fe(III) Complex Compounds For The Treatment And Prophylaxis Of Iron Deficiency Symptoms And Iron Deficiency Anemias FECH, SDHB, SLC40A1 ALDH1A1 1539/4885NPC1 781/4885SMN1; SMN2 3363/4885
US-20160310459-A1 Fe(III) Complex Compounds For The Treatment And Prophylaxis Of Iron Deficiency Symptoms And Iron Deficiency Anemias FECH, SDHB, SLC40A1 ALDH1A1 1539/4885NPC1 781/4885SMN1; SMN2 3363/4885

“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.