SCHEMBL6723449

SCHEMBL6723449

Cc1ccc(NC(=O)C(NC(=S)Nc2ccccc2[N+](=O)[O-])c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.50
MAPT P10636 6/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
ALDH1A1 P00352 9/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
LMNA P02545 2/20 0.48
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
HPN P05981 2/20 0.44
PLAU P00749 1/20 0.44
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HTT P42858 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
SCHEMBL6717195 0.92 MAPT (0.54) SMN1; SMN2MAPTNPC1RAB9AL3MBTL1
SCHEMBL6716796 0.91 SMN1; SMN2 (0.52) SMN1; SMN2MAPTNPC1RAB9AL3MBTL1
SCHEMBL6717145 0.90 MAPT (0.50) SMN1; SMN2MAPTNPC1RAB9AL3MBTL1
SCHEMBL6722741 0.89 MAPT (0.49) SMN1; SMN2MAPTNPC1RAB9AL3MBTL1
SCHEMBL6717350 0.89 PHGDH (0.51) SMN1; SMN2MAPTNPC1RAB9AL3MBTL1
SCHEMBL6717586 0.89 MEN1 (0.49) SMN1; SMN2MAPTNPC1RAB9AL3MBTL1
SCHEMBL6716834 0.87 ALDH1A1 (0.56) SMN1; SMN2MAPTNPC1RAB9AL3MBTL1
SCHEMBL6713812 0.87 ALDH1A1 (0.56) SMN1; SMN2MAPTNPC1RAB9AL3MBTL1
SCHEMBL6717690 0.85 POLB (0.47) SMN1; SMN2MAPTNPC1RAB9AL3MBTL1
SCHEMBL6713795 0.85 ALDH1A1 (0.54) SMN1; SMN2MAPTNPC1RAB9AL3MBTL1

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 SMN1; SMN2 1805/4885MAPT 427/4885NPC1 120/4885

“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.