SCHEMBL6714166

SCHEMBL6714166

COc1ccc(NC(=O)N(S)[C@H](CC(C)C)C(=O)Nc2c(C)cccc2C)c([N+](=O)[O-])c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.48
RAB9A P51151 8/20 0.48
NPC1 O15118 7/20 0.48
ALDH1A1 P00352 3/20 0.48
MEN1 O00255 6/20 0.46
KMT2A Q03164 6/20 0.46
SMN1; SMN2 Q16637 6/20 0.46
MAPK1 P28482 2/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2C19 P33261 1/20 0.46
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.44
THRB P10828 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 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
SCHEMBL6714246 1.00 MAPT (0.48) MAPTRAB9ANPC1ALDH1A1MEN1
SCHEMBL6713993 0.91 MAPT (0.48) MAPTRAB9ANPC1ALDH1A1MEN1
SCHEMBL6715694 0.83 RAB9A (0.52) MAPTRAB9ANPC1ALDH1A1MEN1
SCHEMBL6716824 0.80 MAPT (0.49) MAPTRAB9ANPC1ALDH1A1MEN1
SCHEMBL6718752 0.80 MAPT (0.49) MAPTRAB9ANPC1ALDH1A1MEN1
SCHEMBL6714168 0.80 MEN1 (0.56) MAPTRAB9ANPC1ALDH1A1MEN1
SCHEMBL6714162 0.80 MEN1 (0.56) MAPTRAB9ANPC1ALDH1A1MEN1
SCHEMBL6717674 0.79 RAB9A (0.47) MAPTRAB9ANPC1ALDH1A1MEN1
SCHEMBL6716242 0.78 KMT2A (0.44) MAPTRAB9ANPC1ALDH1A1MEN1
SCHEMBL6723757 0.78 MAPT (0.48) MAPTRAB9ANPC1ALDH1A1MEN1

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 claimed
US-20040152740-A1 Arylglycine derivatives for use as glycine transport inhibitors NPS ALLELIX CORPORATION (CA) 2004-08-05 US 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 2094/4885NPC1 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.