SCHEMBL6096841

SCHEMBL6096841

COc1ccc(CNC(=O)[C@@H](C)c2ccc(F)cc2)cc1OC

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
KMT2A Q03164 3/20 0.58
MEN1 O00255 2/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
MAPK1 P28482 1/20 0.52
MAPT P10636 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
CTSD P07339 1/20 0.51
ERCC1 P07992 1/20 0.50
ERCC4 Q92889 1/20 0.50
CARM1 Q86X55 1/20 0.50
PRMT6 Q96LA8 1/20 0.50

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
SCHEMBL6096837 1.00 ALDH1A1 (0.58) ALDH1A1KMT2AMEN1L3MBTL1MAPK1
SCHEMBL6096835 1.00 ALDH1A1 (0.58) ALDH1A1KMT2AMEN1L3MBTL1MAPK1
SCHEMBL6093048 0.87 ERCC1 (0.66) ALDH1A1KMT2AMEN1MAPK1CTSD
SCHEMBL9028853 0.79 ALDH1A1 (0.68) ALDH1A1KMT2AMEN1L3MBTL1MAPK1
SCHEMBL14644110 0.78 LMNA (0.55) ALDH1A1KMT2AMEN1L3MBTL1MAPK1
SCHEMBL5018017 0.78 ALDH1A1 (0.66) ALDH1A1KMT2AMEN1MAPK1CTSD
SCHEMBL29224595 0.78 ERCC1 (0.74) KMT2AMEN1NPSR1ERCC1ERCC4
SCHEMBL29224596 0.78 ERCC1 (0.74) KMT2AMEN1NPSR1ERCC1ERCC4
SCHEMBL29224597 0.78 ERCC1 (0.74) KMT2AMEN1NPSR1ERCC1ERCC4
SCHEMBL9781286 0.77 ALDH1A1 (0.69) ALDH1A1KMT2AMEN1MAPK1CTSD

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 5 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 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 ALDH1A1 1342/4885KMT2A 793/4885MEN1 2183/4885

“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.