SCHEMBL6093048

SCHEMBL6093048

COc1ccc(CNC(=O)C(C)c2ccccc2)cc1OC

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ERCC1 P07992 1/20 0.66
ERCC4 Q92889 1/20 0.66
KMT2A Q03164 3/20 0.65
MEN1 O00255 2/20 0.65
ALDH1A1 P00352 3/20 0.61
SMN1; SMN2 Q16637 1/20 0.58
GAA P10253 2/20 0.58
KDM4E B2RXH2 1/20 0.58
CYP3A4 P08684 1/20 0.58
ALOX15 P16050 1/20 0.58
TSHR P16473 1/20 0.58
RAB9A P51151 1/20 0.58
MAPK1 P28482 1/20 0.57
POLB P06746 1/20 0.55
ATM Q13315 1/20 0.55
CTSD P07339 2/20 0.54

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
SCHEMBL29224597 0.90 ERCC1 (0.74) ERCC1ERCC4KMT2AMEN1GAA
SCHEMBL29224595 0.90 ERCC1 (0.74) ERCC1ERCC4KMT2AMEN1GAA
SCHEMBL29224596 0.90 ERCC1 (0.74) ERCC1ERCC4KMT2AMEN1GAA
SCHEMBL6094268 0.87 ALDH1A1 (0.62) KMT2AMEN1ALDH1A1SMN1; SMN2TSHR
SCHEMBL6096835 0.87 ALDH1A1 (0.58) ERCC1ERCC4KMT2AMEN1ALDH1A1
SCHEMBL6096837 0.87 ALDH1A1 (0.58) ERCC1ERCC4KMT2AMEN1ALDH1A1
SCHEMBL6096841 0.87 ALDH1A1 (0.58) ERCC1ERCC4KMT2AMEN1ALDH1A1
SCHEMBL10693790 0.83 KMT2A (0.60) KMT2AMEN1ALDH1A1SMN1; SMN2GAA
SCHEMBL5018017 0.82 ALDH1A1 (0.66) KMT2AMEN1ALDH1A1SMN1; SMN2GAA
SCHEMBL10054191 0.82 POLB (0.67) KMT2AMEN1ALDH1A1SMN1; SMN2GAA

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7078565-B2 Benzamide derivatives as antagonists of orexin receptors SMITHKLINE BEECHAM PLC (GB) 2006-07-18 US claimed
EP-1440052-B1 BENZAMIDE DERIVATIVES AS ANTAGONISTS OF OREXIN RECEPTORS SMITHKLINE BEECHAM PLC (GB) 2005-12-14 EP claimed
US-7078565-B2 Benzamide derivatives as antagonists of orexin receptors SMITHKLINE BEECHAM PLC (GB) 2006-07-18 US disclosed
EP-1440052-B1 BENZAMIDE DERIVATIVES AS ANTAGONISTS OF OREXIN RECEPTORS SMITHKLINE BEECHAM PLC (GB) 2005-12-14 EP disclosed
US-20050020584-A1 Benzamide derivatives as antagonists of orexin receptors SMITHKLINE BEECHAM P.L.C. (GB) 2005-01-27 US disclosed
EP-1440052-A1 BENZAMIDE DERIVATIVES AS ANTAGONISTS OF OREXIN RECEPTORS SMITHKLINE BEECHAM PLC (GB) 2004-07-28 EP disclosed
WO-2003037847-A1 BENZAMIDE DERIVATIVES AS ANTAGONISTS OF OREXIN RECEPTORS SMITHKLINE BEECHAM P.L.C. (GB) 2003-05-08 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-20050020584-A1 Benzamide derivatives as antagonists of orexin receptors HCRTR2, HCRTR1, OXTR ERCC1 4844/4885ERCC4 4794/4885KMT2A 793/4885

“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.