SCHEMBL6715871

SCHEMBL6715871

COc1ccc([N+](=O)[O-])cc1NC(=S)NC(C(=O)Nc1c(C)cccc1Cl)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.60
KMT2A Q03164 8/20 0.60
MAPT P10636 7/20 0.60
LMNA P02545 7/20 0.60
ALDH1A1 P00352 6/20 0.60
SMN1; SMN2 Q16637 4/20 0.60
HTT P42858 3/20 0.60
HPGD P15428 1/20 0.52
THRB P10828 1/20 0.51
CYP1A2 P05177 2/20 0.50
CYP3A4 P08684 2/20 0.50
CYP2D6 P10635 2/20 0.50
CYP2C19 P33261 2/20 0.50
POLB P06746 1/20 0.50
MAPK1 P28482 1/20 0.50
TP53 P04637 1/20 0.50
KDM4E B2RXH2 1/20 0.47
CYP2C9 P11712 1/20 0.47
NPSR1 Q6W5P4 2/20 0.47
ALOX12 P18054 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
SCHEMBL6715796 0.90 MEN1 (0.57) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL6719739 0.89 MAPT (0.57) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL6720018 0.88 MEN1 (0.63) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL6726366 0.87 MEN1 (0.60) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL6726536 0.86 MEN1 (0.61) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL6719096 0.85 MEN1 (0.67) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL6718315 0.84 MEN1 (0.63) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL6726499 0.84 ALDH1A1 (0.67) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL6723754 0.84 ALDH1A1 (0.57) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL6726480 0.84 ALDH1A1 (0.60) MEN1KMT2AMAPTLMNAALDH1A1

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 MEN1 2822/4885KMT2A 1656/4885MAPT 694/4885

“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.