SCHEMBL1997135

SCHEMBL1997135

COc1cc2c(ccn2S(=O)(=O)c2ccccc2C)c2c1OCCNC2(C)OC(=O)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 6/20 0.39
HTR6 P50406 8/20 0.34
BRD4 O60885 1/20 0.33
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
HTR2C P28335 1/20 0.30

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
SCHEMBL1995691 0.92 HTR6 (0.43) FABP4HTR6BRD4
SCHEMBL1994708 0.89 CPT2 (0.37) FABP4HTR6
SCHEMBL2002914 0.88 HTR6 (0.40) FABP4HTR6
SCHEMBL1998595 0.87 HTR6 (0.34) FABP4HTR6
Trifluoroacetic Acid SCHEMBL1997134 0.77 FABP4 (0.38) FABP4HTR6BRD4
SCHEMBL1994437 0.77 HTR6 (0.46) FABP4HTR6HTR2C
SCHEMBL1999130 0.73 FABP4 (0.37) FABP4HTR6BRD4PDE4APDE4B
Trifluoroacetic Acid SCHEMBL1995689 0.69 HTR6 (0.39) FABP4HTR6BRD4
SCHEMBL1998511 0.68 FABP4 (0.37) FABP4HTR6
SCHEMBL1998909 0.66 HTR6 (0.38) HTR6HTR2C

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 2 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
US-20080176829-A1 Compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2008-07-24 US 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 1/4885BRD4 3094/4885

“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.