SCHEMBL1552548

SCHEMBL1552548

FC(F)(F)c1ccc(COc2ccc(C[C@@H]3CNCCO3)cc2Cl)o1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 11/20 0.52
HTR6 P50406 2/20 0.52
HTR2C P28335 1/20 0.48
HTR2B P41595 1/20 0.48
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
EPHA2 P29317 1/20 0.36
HTR2A P28223 2/20 0.36
KMT2A Q03164 2/20 0.36
EGFR P00533 1/20 0.36
ERBB2 P04626 1/20 0.36

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
SCHEMBL1552657 1.00 SLC6A4 (0.52) SLC6A4HTR6HTR2CHTR2BNPC1
SCHEMBL1552470 0.83 SLC6A4 (0.41) SLC6A4HTR2BEPHA2HTR2A
SCHEMBL1552474 0.83 SLC6A4 (0.41) SLC6A4HTR2BEPHA2HTR2A
SCHEMBL1552050 0.78 SLC6A4 (0.56) SLC6A4HTR2CHTR2BHTR2AKMT2A
SCHEMBL1552051 0.78 SLC6A4 (0.56) SLC6A4HTR2CHTR2BHTR2AKMT2A
SCHEMBL1552512 0.76 SLC6A4 (0.45) SLC6A4HTR6HTR2BEPHA2HTR2A
SCHEMBL1552514 0.76 SLC6A4 (0.45) SLC6A4HTR6HTR2BEPHA2HTR2A
SCHEMBL1552886 0.76 SLC6A4 (0.45) SLC6A4HTR6HTR2BEPHA2HTR2A
SCHEMBL1552460 0.76 CSNK2A1 (0.51) SLC6A4HTR2BNPC1RAB9AEPHA2
SCHEMBL1552459 0.76 CSNK2A1 (0.51) SLC6A4HTR2BNPC1RAB9AEPHA2

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 12 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
US-20060178510-A1 New morpholine derivatives as 5HT2C receptor agonists for the treatment of obesity HOFFMANN-LA ROCHE INC. 2006-08-10 US claimed
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
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 SLC6A4 89/4885HTR6 23/4885HTR2C 1/4885

“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.