SCHEMBL4930833

SCHEMBL4930833

N[C@@H](Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1)C(=O)NO

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.66
SMN1; SMN2 Q16637 3/20 0.58
CA12 O43570 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA9 Q16790 1/20 0.56
KMT2A Q03164 4/20 0.53
MEN1 O00255 3/20 0.53
MAPK1 P28482 1/20 0.53
CSK P41240 1/20 0.51
TSHR P16473 1/20 0.49
HDAC1 Q13547 4/20 0.48
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.47
HPGD P15428 1/20 0.47
MAPT P10636 1/20 0.46
HDAC3 O15379 3/20 0.46
HDAC2 Q92769 3/20 0.46
HDAC6 Q9UBN7 3/20 0.46
HDAC8 Q9BY41 2/20 0.46

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
SCHEMBL4930854 1.00 GAA (0.66) GAASMN1; SMN2CA12CA1CA2
SCHEMBL15577693 0.83 GAA (0.54) GAASMN1; SMN2KMT2AMEN1MAPK1
SCHEMBL4934991 0.79 CSK (0.60) SMN1; SMN2CA12CA1CA2CA9
SCHEMBL4934979 0.79 CSK (0.60) SMN1; SMN2CA12CA1CA2CA9
SCHEMBL28507926 0.77 GAA (0.83) GAASMN1; SMN2CA12CA1CA2
SCHEMBL2840800 0.77 GAA (0.62) GAASMN1; SMN2CA12CA1CA2
SCHEMBL4935140 0.76 HDAC8 (0.55) CA12CA1CA2CA9CSK
SCHEMBL4935136 0.76 HDAC8 (0.55) CA12CA1CA2CA9CSK
SCHEMBL20715466 0.76 GAA (0.76) GAASMN1; SMN2CA12CA1CA2
SCHEMBL30453035 0.76 BACE1 (0.60) KMT2AHDAC8

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-20080132539-A1 Hydroxamic Acid Derivative And Age Generation Inhibitor Containing The Derivative KUREHA CORPORATION (JP) 2008-06-05 US disclosed
EP-1707560-A1 HYDROXAMIC ACID DERIVATIVE AND AGE GENERATION INHIBITOR CONTAINING THE DERIVATIVE Kureha Corporation (JP) 2006-10-04 EP 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-20080132539-A1 Hydroxamic Acid Derivative And Age Generation Inhibitor Containing The Derivative HDAC5, HDAC1, HDAC9 GAA 107/4885SMN1; SMN2 3068/4885CA12 2701/4885

“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.