SCHEMBL6723567

SCHEMBL6723567

CC(C)(C)N(C(=O)O)C(C(=O)Nc1ccccc1C#N)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.54
GAA P10253 6/20 0.50
KDM4E B2RXH2 5/20 0.50
PDK1 Q15118 1/20 0.48
PDK2 Q15119 1/20 0.48
PDK3 Q15120 1/20 0.48
PDK4 Q16654 1/20 0.48
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 4/20 0.43
TSHR P16473 1/20 0.43
GLA P06280 1/20 0.43
HPGD P15428 1/20 0.43
CYP1A2 P05177 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CXCR2 P25025 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL6716835 0.82 CYP1A2 (0.48) GAAPDK1PDK2PDK3PDK4
SCHEMBL6716842 0.82 CYP1A2 (0.48) GAAPDK1PDK2PDK3PDK4
SCHEMBL6716822 0.81 KCNQ2 (0.56) L3MBTL1GAAKDM4EPDK1PDK2
SCHEMBL6723623 0.80 POLB (0.51) GAAKMT2AMEN1ALDH1A1HSD17B10
SCHEMBL6715907 0.80 KMT2A (0.50) L3MBTL1GAAKMT2AMEN1ALDH1A1
SCHEMBL6715819 0.79 POLB (0.49) L3MBTL1GAAKDM4EKMT2AMEN1
SCHEMBL6719510 0.79 MAPT (0.55) L3MBTL1KDM4EPDK1PDK2PDK3
SCHEMBL6719501 0.79 MAPT (0.46) KMT2AMEN1TDP1ALDH1A1TSHR
SCHEMBL6717099 0.78 TSHR (0.53) GAAKDM4EKMT2ATDP1ALDH1A1
SCHEMBL6715913 0.78 MDM4 (0.41) L3MBTL1GAAKMT2AMEN1ALDH1A1

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 L3MBTL1 3509/4885GAA 136/4885KDM4E 3734/4885

“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.