SCHEMBL6717570

SCHEMBL6717570

CCCCOC(=O)c1ccccc1OC(=O)CN

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.65
TDP1 Q9NUW8 3/20 0.65
L3MBTL1 Q9Y468 2/20 0.65
ALDH1A1 P00352 8/20 0.61
HSD17B10 Q99714 2/20 0.61
CYP3A4 P08684 5/20 0.59
MAPK1 P28482 3/20 0.59
TP53 P04637 1/20 0.59
LMNA P02545 3/20 0.57
KDM4E B2RXH2 3/20 0.55
POLB P06746 1/20 0.55
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
RECQL P46063 1/20 0.52
PTGS2 P35354 1/20 0.50
MAPT P10636 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
NR1I2 O75469 1/20 0.46
CHRM2 P08172 1/20 0.46
ADRA2A P08913 1/20 0.46

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
SCHEMBL11427518 0.89 TSHR (0.69) TSHRTDP1L3MBTL1ALDH1A1HSD17B10
SCHEMBL10785200 0.86 TSHR (0.69) TSHRTDP1L3MBTL1ALDH1A1HSD17B10
SCHEMBL1282684 0.85 TSHR (0.73) TSHRTDP1L3MBTL1ALDH1A1HSD17B10
SCHEMBL28026739 0.85 TSHR (0.63) TSHRTDP1L3MBTL1ALDH1A1HSD17B10
SCHEMBL11328998 0.84 TSHR (0.69) TSHRTDP1L3MBTL1ALDH1A1HSD17B10
SCHEMBL5158356 0.84 TSHR (0.71) TSHRTDP1L3MBTL1ALDH1A1HSD17B10
SCHEMBL4398193 0.84 TSHR (0.71) TSHRTDP1L3MBTL1ALDH1A1HSD17B10
SCHEMBL5158365 0.84 TSHR (0.71) TSHRTDP1L3MBTL1ALDH1A1HSD17B10
SCHEMBL1870045 0.84 TSHR (0.71) TSHRTDP1L3MBTL1ALDH1A1HSD17B10
SCHEMBL28026686 0.84 TSHR (0.61) TSHRTDP1L3MBTL1ALDH1A1HSD17B10

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 TSHR 3060/4885TDP1 1032/4885L3MBTL1 3509/4885

“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.