SCHEMBL6716729

SCHEMBL6716729

CCCCOC(=O)NC(C(=O)Nc1ccccc1C)c1ccsc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.45
SCN1A P35498 1/20 0.45
SCN2A Q99250 1/20 0.45
SCN3A Q9NY46 1/20 0.45
LMNA P02545 3/20 0.44
HPGD P15428 3/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 7/20 0.43
CYP1A2 P05177 3/20 0.43
CYP2C19 P33261 3/20 0.43
NPC1 O15118 6/20 0.40
RAB9A P51151 6/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 3/20 0.39
MAPK1 P28482 1/20 0.39
ANPEP P15144 1/20 0.38
NFKB1 P19838 1/20 0.38
STAT1 P42224 1/20 0.38
NFKB2 Q00653 1/20 0.38

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
SCHEMBL8347137 0.83 CTSS (0.46) PGRSCN1ASCN2ASCN3ALMNA
SCHEMBL2015729 0.81 SMN1; SMN2 (0.44) LMNAHPGDMAPTSMN1; SMN2CYP1A2
SCHEMBL13506223 0.77 SMN1; SMN2 (0.68) LMNAHPGDMAPTSMN1; SMN2CYP1A2
SCHEMBL6723698 0.74 KMT2A (0.47) PGRSCN1ASCN2ASCN3ALMNA
SCHEMBL29290659 0.73 SMN1; SMN2 (0.62) LMNAHPGDMAPTSMN1; SMN2CYP1A2
SCHEMBL6716864 0.72 PGR (0.47) PGRSCN1ASCN2ASCN3ALMNA
SCHEMBL5504022 0.72 SMN1; SMN2 (0.42) LMNAHPGDMAPTSMN1; SMN2NPC1
SCHEMBL6714210 0.71 ALDH1A1 (0.49) LMNAHPGDGAAMAPTSMN1; SMN2
SCHEMBL6824939 0.71 POLB (0.46) PGRSCN1ASCN2ASCN3ALMNA
SCHEMBL6717473 0.71 ALDH1A1 (0.50) LMNAGAAMAPTSMN1; SMN2NPC1

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 1 patent. 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

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 PGR 2543/4885SCN1A 699/4885SCN2A 1166/4885

“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.