SCHEMBL1553075

SCHEMBL1553075

COc1ccc(CC2CNCCO2)cc1C(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 1/20 0.48
EPHA2 P29317 2/20 0.43
HTR2A P28223 10/20 0.43
HTR2B P41595 4/20 0.43
HTR2C P28335 3/20 0.43
SLC6A4 P31645 4/20 0.42
SLC6A2 P23975 3/20 0.42
HTR1A P08908 2/20 0.41
HTR1D P28221 1/20 0.41
HTR1E P28566 1/20 0.41
ADORA2A P29274 1/20 0.41
ADORA2B P29275 1/20 0.41
HTR7 P34969 1/20 0.41
HTR6 P50406 1/20 0.41
ADRB2 P07550 1/20 0.40
ADRA1A P35348 1/20 0.40
SLC6A3 Q01959 1/20 0.40
S1PR1 P21453 1/20 0.39
REN P00797 1/20 0.39

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
SCHEMBL1552591 1.00 ADRA2C (0.48) ADRA2CEPHA2HTR2AHTR2BHTR2C
SCHEMBL1552157 0.88 SLC6A4 (0.52) ADRA2CEPHA2HTR2AHTR2BHTR2C
SCHEMBL1552594 0.88 SLC6A4 (0.52) ADRA2CEPHA2HTR2AHTR2BHTR2C
SCHEMBL1552214 0.87 HTR2A (0.41) ADRA2CEPHA2HTR2AHTR2BSLC6A4
SCHEMBL1552209 0.87 HTR2A (0.41) ADRA2CEPHA2HTR2AHTR2BSLC6A4
SCHEMBL14289470 0.85 OPRK1 (0.39) ADRA2CEPHA2HTR2AHTR2BSLC6A4
SCHEMBL1552787 0.84 HTR2A (0.44) ADRA2CEPHA2HTR2AHTR2BSLC6A4
SCHEMBL1552786 0.84 HTR2A (0.44) ADRA2CEPHA2HTR2AHTR2BSLC6A4
SCHEMBL1551845 0.84 ADRA2C (0.51) ADRA2CEPHA2HTR2AHTR2BSLC6A4
SCHEMBL1551848 0.84 ADRA2C (0.51) ADRA2CEPHA2HTR2AHTR2BSLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1844026-B1 MORPHOLINES AS 5HT2C AGONISTS HOFFMANN LA ROCHE (CH) 2011-04-27 EP claimed
US-7323466-B2 Morpholine derivatives as 5HT2C receptor agonists for the treatment of obesity HOFFMAN-LA ROCHE INC. (US) 2008-01-29 US claimed
EP-1844026-A2 MORPHOLINES AS 5HT2C AGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2007-10-17 EP claimed
US-20060178510-A1 New morpholine derivatives as 5HT2C receptor agonists for the treatment of obesity HOFFMANN-LA ROCHE INC. 2006-08-10 US claimed
WO-2006077025-A2 MORPHOLINES AS 5HT2C AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2006-07-27 WO claimed
EP-1844026-B1 MORPHOLINES AS 5HT2C AGONISTS HOFFMANN LA ROCHE (CH) 2011-04-27 EP disclosed
US-7323466-B2 Morpholine derivatives as 5HT2C receptor agonists for the treatment of obesity HOFFMAN-LA ROCHE INC. (US) 2008-01-29 US disclosed
EP-1844026-A2 MORPHOLINES AS 5HT2C AGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2007-10-17 EP disclosed
US-20060178510-A1 New morpholine derivatives as 5HT2C receptor agonists for the treatment of obesity HOFFMANN-LA ROCHE INC. 2006-08-10 US disclosed
WO-2006077025-A2 MORPHOLINES AS 5HT2C AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2006-07-27 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-20060178510-A1 New morpholine derivatives as 5HT2C receptor agonists for the treatment of obesity HTR2C, HTR1A, HTR1B ADRA2C 16/4885EPHA2 3530/4885HTR2A 4/4885

“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.