SCHEMBL6488101

SCHEMBL6488101

NN(C[C@@H](O)CO)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
AOC3 Q16853 3/20 0.40
POLB P06746 1/20 0.38
APOBEC3A P31941 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
CYP1A2 P05177 3/20 0.37
AGTR1 P30556 1/20 0.37
LMNA P02545 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 1/20 0.36
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
ADRA2A P08913 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
CYP2C19 P33261 1/20 0.35
KCNA5 P22460 1/20 0.35
KCNJ5 P48544 1/20 0.35

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
SCHEMBL12859087 0.79 KDM4E (0.62) KDM4EL3MBTL1AOC3POLBAPOBEC3A
SCHEMBL8959067 0.79 KDM4E (0.44) KDM4EL3MBTL1POLBAPOBEC3AAPOBEC3G
SCHEMBL6492940 0.76 KDM4E (0.49) KDM4EL3MBTL1AOC3POLBAPOBEC3A
SCHEMBL17137792 0.73 AOC3 (0.38) KDM4EL3MBTL1AOC3POLBAPOBEC3A
SCHEMBL1059610 0.73 TSHR (0.48) KDM4EL3MBTL1POLBAPOBEC3AAPOBEC3G
SCHEMBL4946334 0.72 AOC3 (0.50) AOC3POLBAPOBEC3AAPOBEC3GLMNA
SCHEMBL7355561 0.72 TSHR (0.52) KDM4ECYP1A2LMNAMEN1KMT2A
SCHEMBL10878932 0.71 ALDH1A1 (0.46) KDM4EL3MBTL1LMNAMEN1KMT2A
SCHEMBL4468683 0.70 KDM4E (0.43) KDM4EL3MBTL1AOC3POLBCYP1A2
SCHEMBL6477129 0.69 AOC3 (0.38) KDM4EL3MBTL1AOC3CYP1A2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6887863-B2 Hydrazide and alkoxyamide angiogenesis inhibitors ABBOTT LABORATORIES (US) 2005-05-03 US disclosed
EP-1272456-B1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS ABBOTT LAB (US) 2004-10-27 EP disclosed
US-20040167126-A1 Hydrazide and alkoxyamide angiogenesis inhibitors ABBVIE INC. 2004-08-26 US disclosed
EP-1272456-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS Abbott Laboratories (US) 2003-01-08 EP disclosed
US-20020002152-A1 Hydrazide and alkoxyamide angiogenesis inhibitors ABBOTT LABORATORIES 2002-01-03 US disclosed
WO-2001079157-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS ABBOTT LABORATORIES (US) 2001-10-25 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 (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-20040167126-A1 Hydrazide and alkoxyamide angiogenesis inhibitors METAP2, METAP1, ANPEP KDM4E 1796/4885L3MBTL1 2554/4885AOC3 1365/4885
US-20020002152-A1 Hydrazide and alkoxyamide angiogenesis inhibitors METAP2, METAP1, ANPEP KDM4E 1796/4885L3MBTL1 2554/4885AOC3 1365/4885

“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.