SCHEMBL4927100

SCHEMBL4927100

CCCN[C@@H](CCc1nc2ccccc2n1C)C(=O)NO

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.57
TSHR P16473 2/20 0.56
HDAC6 Q9UBN7 1/20 0.51
ALDH1A1 P00352 1/20 0.51
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
NTRK1 P04629 3/20 0.45
NTRK2 Q16620 2/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL4927125 1.00 RECQL (0.57) RECQLTSHRHDAC6ALDH1A1GAA
SCHEMBL4930904 0.92 RECQL (0.53) RECQLTSHRHDAC6ALDH1A1GAA
SCHEMBL4930921 0.92 RECQL (0.53) RECQLTSHRHDAC6ALDH1A1GAA
SCHEMBL4934072 0.89 MEN1 (0.53) GAAMAPTNPC1SMN1; SMN2MEN1
SCHEMBL4934085 0.89 MEN1 (0.53) GAAMAPTNPC1SMN1; SMN2MEN1
SCHEMBL4930830 0.81 RECQL (0.48) RECQLTSHRHDAC6ALDH1A1GAA
SCHEMBL4930826 0.81 RECQL (0.48) RECQLTSHRHDAC6ALDH1A1GAA
SCHEMBL4935306 0.80 RECQL (0.59) RECQLTSHRHDAC6ALDH1A1GAA
SCHEMBL4935298 0.80 RECQL (0.59) RECQLTSHRHDAC6ALDH1A1GAA
SCHEMBL4932155 0.76 SMN1; SMN2 (0.46) RECQLALDH1A1GAAMAPTNPC1

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 RECQL 3225/4885TSHR 4517/4885HDAC6 10/4885

“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.