SCHEMBL1551875

SCHEMBL1551875

Fc1ccc(C[C@@H]2CNCCO2)cc1C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHA2 P29317 1/20 0.44
SLC6A4 P31645 5/20 0.43
HTR2A P28223 2/20 0.43
DRD4 P21917 1/20 0.43
SOS1 Q07889 1/20 0.40
HTR1A P08908 1/20 0.39
P2RX7 Q99572 1/20 0.38
CHEK1 O14757 4/20 0.37
KCNH2 Q12809 2/20 0.37
NUAK1 O60285 1/20 0.37
CHEK2 O96017 1/20 0.37
CDK1 P06493 1/20 0.37
CCNB1 P14635 1/20 0.37
FLT1 P17948 1/20 0.37
MARK3 P27448 1/20 0.37
KDR P35968 1/20 0.37
FLT3 P36888 1/20 0.37
CLK2 P49760 1/20 0.37
RPS6KA3 P51812 1/20 0.37
PRKAG1 P54619 1/20 0.37

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
SCHEMBL1551879 1.00 EPHA2 (0.44) EPHA2SLC6A4HTR2ADRD4SOS1
SCHEMBL14289470 0.87 OPRK1 (0.39) EPHA2SLC6A4HTR2AHTR1ACHEK1
SCHEMBL1552591 0.83 ADRA2C (0.48) EPHA2SLC6A4HTR2AHTR1ASLC6A2
SCHEMBL1553075 0.83 ADRA2C (0.48) EPHA2SLC6A4HTR2AHTR1ASLC6A2
SCHEMBL1552774 0.82 SLC6A2 (0.46) SLC6A4HTR2ADRD4SOS1KCNH2
SCHEMBL1552135 0.82 SLC6A4 (0.45) SLC6A4HTR2ASOS1HTR1AKCNH2
SCHEMBL1552209 0.82 HTR2A (0.41) EPHA2SLC6A4HTR2AHTR1ASLC6A2
SCHEMBL1552214 0.82 HTR2A (0.41) EPHA2SLC6A4HTR2AHTR1ASLC6A2
SCHEMBL1552594 0.81 SLC6A4 (0.52) EPHA2SLC6A4HTR2AHTR1AKCNH2
SCHEMBL1552157 0.81 SLC6A4 (0.52) EPHA2SLC6A4HTR2AHTR1AKCNH2

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 17 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
CN-101107235-B Morpholines as 5HT2C agonists HOFFMANN LA ROCHE 2011-03-16 CN 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
CN-101107235-A Morpholines as 5HT2C agonists HOFFMANN LA ROCHE (CH) 2008-01-16 CN 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
EP-1844026-B1 MORPHOLINES AS 5HT2C AGONISTS HOFFMANN LA ROCHE (CH) 2011-04-27 EP disclosed
CN-101107235-B Morpholines as 5HT2C agonists HOFFMANN LA ROCHE 2011-03-16 CN 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
US-7323466-B2 Morpholine derivatives as 5HT2C receptor agonists for the treatment of obesity HOFFMAN-LA ROCHE INC. (US) 2008-01-29 US 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
CN-101107235-A Morpholines as 5HT2C agonists HOFFMANN LA ROCHE (CH) 2008-01-16 CN 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 EPHA2 3530/4885SLC6A4 89/4885HTR2A 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.