SCHEMBL6716670

SCHEMBL6716670

CCOc1ccc(NC(=O)N(S)C(C(=O)Nc2ccccc2C)c2ccccc2)c([N+](=O)[O-])c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.54
RAB9A P51151 9/20 0.54
SMN1; SMN2 Q16637 8/20 0.54
NPC1 O15118 8/20 0.54
MAPK1 P28482 3/20 0.54
PKM P14618 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
POLB P06746 2/20 0.54
ALDH1A1 P00352 3/20 0.49
HTT P42858 2/20 0.49
TP53 P04637 1/20 0.49
KMT2A Q03164 6/20 0.48
NFKB1 P19838 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48
MEN1 O00255 5/20 0.46
LMNA P02545 2/20 0.46
MCOLN3 Q8TDD5 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CYP1A2 P05177 2/20 0.45

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
SCHEMBL6716685 0.93 MAPT (0.52) MAPTRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL6714096 0.91 RAB9A (0.47) MAPTRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL6715668 0.90 RAB9A (0.53) MAPTRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL6716840 0.85 KMT2A (0.49) MAPTSMN1; SMN2MAPK1POLBALDH1A1
SCHEMBL6713814 0.85 KMT2A (0.49) MAPTSMN1; SMN2MAPK1POLBALDH1A1
SCHEMBL6716665 0.84 SMN1; SMN2 (0.56) MAPTRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL6715694 0.83 RAB9A (0.52) MAPTRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL6723841 0.83 MAPT (0.52) MAPTRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL6719452 0.82 MAPT (0.51) MAPTRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL6723444 0.81 RAB9A (0.52) MAPTRAB9ASMN1; SMN2NPC1MAPK1

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-20040152740-A1 Arylglycine derivatives for use as glycine transport inhibitors NPS ALLELIX CORPORATION (CA) 2004-08-05 US claimed
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 MAPT 427/4885RAB9A 2094/4885SMN1; SMN2 1805/4885

“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.