SCHEMBL6719072

SCHEMBL6719072

O=C(O)NC(C(=O)Nc1cccc2c1CCCC2)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.51
POLB P06746 1/20 0.51
ALDH1A1 P00352 4/20 0.50
L3MBTL1 Q9Y468 4/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
LMNA P02545 4/20 0.49
THRA P10827 1/20 0.49
THRB P10828 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
HPGD P15428 1/20 0.48
ATM Q13315 1/20 0.48
TSHR P16473 2/20 0.47
TRPV1 Q8NER1 3/20 0.46
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
RXRG P48443 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
SCHEMBL8337985 0.84 CTSS (0.52) KDM4EPOLBALDH1A1L3MBTL1MEN1
SCHEMBL6713821 0.82 KDM4E (0.53) KDM4EPOLBALDH1A1L3MBTL1MEN1
SCHEMBL6716923 0.81 ALDH1A1 (0.46) KDM4EPOLBALDH1A1L3MBTL1MEN1
SCHEMBL6717662 0.80 MAPT (0.47) KDM4EPOLBALDH1A1L3MBTL1MEN1
SCHEMBL9731362 0.80 ALDH1A1 (0.58) KDM4EPOLBALDH1A1L3MBTL1MEN1
SCHEMBL6627142 0.79 ALDH1A1 (0.65) KDM4EPOLBALDH1A1L3MBTL1MEN1
SCHEMBL6727015 0.78 CYP1A2 (0.53) POLBALDH1A1MEN1KMT2ALMNA
SCHEMBL6726608 0.77 MAPT (0.51) POLBALDH1A1MEN1KMT2ALMNA
SCHEMBL12308333 0.76 ALDH1A1 (0.62) KDM4EPOLBALDH1A1L3MBTL1MEN1
SCHEMBL19305874 0.76 ALDH1A1 (0.60) KDM4EPOLBALDH1A1L3MBTL1MEN1

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-2004022534-A1 ARYLGLYCINE DERIVATIVES FOR 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 KDM4E 3346/4885POLB 4412/4885ALDH1A1 575/4885

“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.