SCHEMBL1996187

SCHEMBL1996187

Cc1ccccc1S(=O)(=O)n1ccc2c3c(ccc21)OCCN(C(=O)OC(C)(C)C)C3C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 4/20 0.39
HTR6 P50406 8/20 0.37
DRD2 P14416 2/20 0.36
DRD3 P35462 2/20 0.36
BCHE P06276 1/20 0.35
TGFBR1 P36897 1/20 0.34
MET P08581 1/20 0.34
KLK7 P49862 1/20 0.34
NR1H2 P55055 1/20 0.34
USP30 Q70CQ3 1/20 0.33
RAPGEF4 Q8WZA2 1/20 0.33
EPHX2 P34913 1/20 0.32
PIK3C3 Q8NEB9 1/20 0.31

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
SCHEMBL1994506 0.90 HTR6 (0.46) HTR6DRD2DRD3BCHE
SCHEMBL1995995 0.86 HTR6 (0.36) HTR6DRD2DRD3BCHETGFBR1
SCHEMBL1994638 0.86 ALDH1A1 (0.33) HTR6BCHEMETUSP30
SCHEMBL1998988 0.86 HTR6 (0.33) HTR6BCHEMETUSP30
SCHEMBL2005904 0.85 PKLR (0.37) FABP4HTR6BCHENR1H2
SCHEMBL1996014 0.85 ALDH1A1 (0.38) HTR6BCHEKLK7NR1H2
SCHEMBL1998511 0.84 FABP4 (0.37) FABP4HTR6BCHETGFBR1MET
SCHEMBL1995411 0.84 MCOLN3 (0.37) FABP4HTR6EPHX2
SCHEMBL1998005 0.84 TSHR (0.39)
SCHEMBL1997467 0.84 ALDH1A1 (0.38) HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960374-B2 e.g. 2,5-methylene-9-(phenylsulfonyl)-1,2,3,4,5,9-hexahydro[1,5]oxazocino[3,2-e]indole; serotonin receptors antagonist or partial agonist; metabolic diseases, e.g. obesity, insulin resisitance, type 2 diabetes, eating disorders; antidepressant, anxiolytic agent; cosmetics PROXIMAGEN LIMITED (GB) 2011-06-14 US disclosed
EP-2091953-A1 8-SULFONYL-L, 3, 4, 8-TETRAHYDR0-2H- [1, 4]OXAZEPINO [6, 7-E]INDOLE DERIVATIVES AND THEIR USE AS 5-HT6 RECEPTOR LIGANDS BIOVITRUM AB (publ) (SE) 2009-08-26 EP disclosed
US-20080176829-A1 Compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2008-07-24 US disclosed
WO-2008054288-A1 8-SULFONYL-L, 3, 4, 8-TETRAHYDR0-2H- [1, 4] OXAZEPINO [6, 7-E] INDOLE DERIVATIVES AND THEIR USE AS 5-HT6 RECEPTOR LIGANDS BIOVITRUM AB (PUBL) (SE) 2008-05-08 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-20080176829-A1 Compounds HTR6, HTR1B, HTR1A FABP4 1988/4885HTR6 1/4885DRD2 96/4885

“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.