SCHEMBL4890133

SCHEMBL4890133

COc1cc2c(cc1S(=O)(=O)c1ccc(F)cc1)CN(C(=O)O)CC2

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.57
MEN1 O00255 3/20 0.53
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA7 P43166 1/20 0.52
CA9 Q16790 1/20 0.52
CA14 Q9ULX7 1/20 0.52
ALDH1A1 P00352 3/20 0.51
HSD17B10 Q99714 2/20 0.50
HPGD P15428 1/20 0.50
NPC1 O15118 1/20 0.49
ABCB1 P08183 1/20 0.47
KDM4E B2RXH2 1/20 0.47
ALOX15 P16050 1/20 0.47
THRB P10828 1/20 0.47
MAPK1 P28482 1/20 0.46
MAOB P27338 1/20 0.46
POLB P06746 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL3900136 0.88 KMT2A (0.54) KMT2AMEN1CA1CA2CA7
SCHEMBL13901029 0.86 KMT2A (0.52) KMT2AMEN1CA1CA2CA7
SCHEMBL6140398 0.84 KMT2A (0.48) KMT2AMEN1ALDH1A1NPC1ABCB1
SCHEMBL3903162 0.84 MAOB (0.48) KMT2AMEN1CA1CA2CA7
SCHEMBL3892441 0.80 MAOB (0.43) KMT2AALDH1A1ABCB1KDM4EMAOB
SCHEMBL6517175 0.78 KMT2A (0.43) KMT2AMEN1CA1CA2CA7
SCHEMBL2873071 0.78 MAPK1 (0.65) KMT2AMEN1ALDH1A1HSD17B10NPC1
SCHEMBL3895372 0.78 KMT2A (0.48) KMT2ACA1CA2CA9CA14
SCHEMBL6509242 0.78 MAOB (0.54) KMT2AMEN1KDM4EMAOB
SCHEMBL31412994 0.77 MAPK1 (0.54) KMT2AMEN1ALDH1A1HSD17B10NPC1

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-20080269197-A1 antipsychotic agents; phenylsulfonyl compounds; 7-Methoxy-8-(3-phenoxy-benzenesulfonyl)-2,3,4,5-tetrahydro-1H-3-benzazepine; schizophrenia GLAXO GROUP LIMITED 2008-10-30 US disclosed
EP-1511727-A2 AROMATIC SULFONES AND THEIR MEDICAL USE GLAXO GROUP LIMITED (GB) 2005-03-09 EP disclosed
WO-2003099786-A2 AROMATIC SULFONES AND THEIR MEDICAL USE GLAXO GROUP LIMITED (GB) 2003-12-04 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-20080269197-A1 antipsychotic agents; phenylsulfonyl compounds; 7-Methoxy-8-(3-phenoxy-benzenesulfonyl)-2,3,4,5-tetrahydro-1H-3-benzazepine; schizophrenia SIGMAR1, CBR3, CBR1 KMT2A 2397/4885MEN1 2490/4885CA1 751/4885

“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.