SCHEMBL1998511

SCHEMBL1998511

COc1cc2c(ccn2S(=O)(=O)c2ccccc2C)c2c1OCCN(C(=O)OC(C)(C)C)C2C

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 4/20 0.37
HTR6 P50406 3/20 0.35
TGFBR1 P36897 2/20 0.34
MET P08581 1/20 0.34
BCHE P06276 1/20 0.33
CREBBP Q92793 1/20 0.33
CNR1 P21554 1/20 0.33
NR1H2 P55055 5/20 0.32
EPHX2 P34913 1/20 0.32
NR1H3 Q13133 3/20 0.31
PIK3C3 Q8NEB9 1/20 0.31
GPR119 Q8TDV5 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
SCHEMBL1999848 0.91 HTR6 (0.39) FABP4HTR6TGFBR1METBCHE
SCHEMBL1997745 0.89 TSHR (0.39)
SCHEMBL1995975 0.87 HTR6 (0.37) FABP4HTR6TGFBR1BCHENR1H2
SCHEMBL1997934 0.86 ALDH1A1 (0.36) HTR6
SCHEMBL1996187 0.84 FABP4 (0.39) FABP4HTR6TGFBR1METBCHE
SCHEMBL4418093 0.81 FABP4 (0.40) FABP4HTR6MET
SCHEMBL1999130 0.78 FABP4 (0.37) FABP4HTR6PIK3C3
SCHEMBL1998005 0.78 TSHR (0.39)
SCHEMBL1995411 0.78 MCOLN3 (0.37) FABP4HTR6EPHX2
Trifluoroacetic Acid SCHEMBL1997134 0.77 FABP4 (0.38) FABP4HTR6CNR1PIK3C3

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 1/4885TGFBR1 1906/4885

“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.