SCHEMBL6717735

SCHEMBL6717735

COc1ccc(C)c(NC(=O)C(N)c2ccccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.52
KMT2A Q03164 4/20 0.52
MEN1 O00255 3/20 0.52
MAPK1 P28482 2/20 0.51
MAPT P10636 6/20 0.51
ALDH1A1 P00352 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
LMNA P02545 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
HTT P42858 3/20 0.48
PKM P14618 1/20 0.45
RAB9A P51151 1/20 0.45
BRD4 O60885 1/20 0.44

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
SCHEMBL6827177 0.84 KMT2A (0.52) GAAKMT2AMEN1MAPK1MAPT
SCHEMBL6718886 0.83 BRD4 (0.62) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL8348797 0.81 SLC1A3 (0.48) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL28609335 0.80 RAB9A (0.55) GAAMAPTALDH1A1SMN1; SMN2LMNA
SCHEMBL6718687 0.80 RAB9A (0.55) GAAMAPTALDH1A1SMN1; SMN2LMNA
SCHEMBL6718773 0.80 RAB9A (0.55) GAAMAPTALDH1A1SMN1; SMN2LMNA
SCHEMBL6718171 0.79 KLK7 (0.63) GAAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL6717139 0.78 GAA (0.46) GAAKMT2AMEN1MAPK1MAPT
SCHEMBL3704664 0.78 GAA (0.61) GAAKMT2AMEN1MAPK1MAPT
SCHEMBL8348878 0.77 CTSS (0.54) GAAKMT2AMEN1MAPK1MAPT

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-20040152740-A1 Arylglycine derivatives for use as glycine transport inhibitors NPS ALLELIX CORPORATION (CA) 2004-08-05 US disclosed
WO-2004022534-A1 ARYLGLYCINE DERIVATIVES FOR USE AS GLYCINE TRANSPORT INHIBITORS NPS ALLELIX CORP. (CA) 2004-03-18 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 (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-20040152740-A1 Arylglycine derivatives for use as glycine transport inhibitors SLC1A2, SLC6A7, SLC1A1 GAA 136/4885KMT2A 2020/4885MEN1 2933/4885

“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.