SCHEMBL1552575

SCHEMBL1552575

CC(C)(C)OC(=O)N1CCOC(Cc2ccc(OCc3noc(-c4ccc(C(F)(F)F)cc4)n3)c(Cl)c2)C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PPARD Q03181 3/20 0.42
PPARG P37231 2/20 0.42
PPARA Q07869 2/20 0.42
SPHK2 Q9NRA0 4/20 0.42
SPHK1 Q9NYA1 2/20 0.42
EPHA2 P29317 4/20 0.40
EPHB4 P54760 2/20 0.40
ERBB2 P04626 1/20 0.40
KDR P35968 2/20 0.40
MRGPRX4 Q96LA9 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
STAT3 P40763 1/20 0.38
SMPD1 P17405 1/20 0.38
HDAC4 P56524 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
S1PR1 P21453 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
SCHEMBL1552574 1.00 MAPT (0.44) MAPTMAPK1L3MBTL1PPARDPPARG
SCHEMBL1553384 0.91 SMPD1 (0.42) MAPTMAPK1L3MBTL1PPARDPPARG
SCHEMBL1553330 0.91 SMPD1 (0.42) MAPTMAPK1L3MBTL1PPARDPPARG
SCHEMBL1552767 0.91 TDP1 (0.44) MAPTL3MBTL1EPHA2EPHB4ERBB2
SCHEMBL1552769 0.91 TDP1 (0.44) MAPTL3MBTL1EPHA2EPHB4ERBB2
SCHEMBL1553007 0.79 EPHA2 (0.42) EPHA2EPHB4ERBB2MRGPRX4CYP2C9
SCHEMBL1553005 0.79 EPHA2 (0.42) EPHA2EPHB4ERBB2MRGPRX4CYP2C9
SCHEMBL1553210 0.78 PPARG (0.43) MAPTPPARGPPARAEPHA2EPHB4
SCHEMBL1553213 0.78 PPARG (0.43) MAPTPPARGPPARAEPHA2EPHB4
SCHEMBL1552562 0.78 GPR119 (0.47) EPHA2EPHB4ERBB2GPR119

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 5 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 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 MAPT 3287/4885MAPK1 1536/4885L3MBTL1 4429/4885

“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.