SCHEMBL6719660

SCHEMBL6719660

COc1ccc([N+](=O)[O-])cc1NC(=O)NC(C(=O)Nc1ccc2ccccc2c1)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 10/20 0.60
MEN1 O00255 9/20 0.60
LMNA P02545 5/20 0.60
POLB P06746 2/20 0.60
MAPK1 P28482 2/20 0.60
MAPT P10636 8/20 0.58
BLM P54132 1/20 0.58
SMN1; SMN2 Q16637 5/20 0.57
TP53 P04637 2/20 0.57
HPGD P15428 2/20 0.56
ALDH1A1 P00352 6/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C19 P33261 1/20 0.55
HTT P42858 1/20 0.51
KCNMA1 Q12791 1/20 0.48
NPSR1 Q6W5P4 1/20 0.47

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
SCHEMBL6726592 0.92 MEN1 (0.60) KMT2AMEN1LMNAPOLBMAPK1
SCHEMBL6719557 0.92 KMT2A (0.67) KMT2AMEN1LMNAPOLBMAPK1
SCHEMBL6715520 0.91 MEN1 (0.69) KMT2AMEN1LMNAPOLBMAPK1
SCHEMBL6715844 0.89 MEN1 (0.60) KMT2AMEN1LMNAPOLBMAPK1
SCHEMBL6726360 0.89 MEN1 (0.60) KMT2AMEN1LMNAPOLBMAPK1
SCHEMBL6718147 0.89 MEN1 (0.54) KMT2AMEN1LMNAPOLBMAPK1
SCHEMBL6719654 0.89 MEN1 (0.66) KMT2AMEN1LMNAPOLBMAPK1
SCHEMBL6719353 0.89 MEN1 (0.66) KMT2AMEN1LMNAPOLBMAPK1
SCHEMBL6726961 0.89 MEN1 (0.66) KMT2AMEN1LMNAPOLBMAPK1
SCHEMBL6719596 0.88 MEN1 (0.64) KMT2AMEN1LMNAPOLBMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040152741-A1 Arylglycine derivatives and their use as glycine transport inhibitors NPS ALLELIX CORPORATION (CA) 2004-08-05 US disclosed
WO-2004022528-A2 ARYLGLYCINE DERIVATIVES AND THEIR USE AS GLYCINE TRANSPORT INHIBITORS NPS ALLELIX CORP. (CA) 2004-03-18 WO disclosed
WO-2004022528-A2 ARYLGLYCINE DERIVATIVES AND THEIR 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-20040152741-A1 Arylglycine derivatives and their use as glycine transport inhibitors SLC1A2, SLC1A1, SLC7A11 KMT2A 1656/4885MEN1 2822/4885LMNA 3809/4885

“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.