SCHEMBL4552178

SCHEMBL4552178

C#Cc1ccc(OCc2cccc(F)c2)cc1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOB P27338 15/20 0.67
NR4A2 P43354 2/20 0.60
PARP10 Q53GL7 1/20 0.58
FFAR1 O14842 1/20 0.53
MAOA P21397 2/20 0.52

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
SCHEMBL27521276 0.84 MAOB (0.77) MAOBNR4A2PARP10MAOA
SCHEMBL21115293 0.84 MAOB (0.50) MAOBNR4A2PARP10MAOA
SCHEMBL993129 0.84 MAOB (0.67) MAOBNR4A2PARP10FFAR1MAOA
SCHEMBL15171108 0.81 MAOB (0.73) MAOBNR4A2PARP10MAOA
SCHEMBL3625818 0.81 MAOB (0.73) MAOBNR4A2PARP10MAOA
SCHEMBL11959694 0.81 MAOB (0.72) MAOBNR4A2PARP10MAOA
SCHEMBL4552784 0.81 MAOB (0.67) MAOBNR4A2MAOA
SCHEMBL22874674 0.80 MAOB (0.71) MAOBNR4A2PARP10FFAR1MAOA
SCHEMBL21340832 0.80 MAOB (0.79) MAOBNR4A2PARP10MAOA
SCHEMBL4552204 0.80 MAOB (0.71) MAOBNR4A2PARP10MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1761480-B1 MAO-B INHIBITORS HOFFMANN LA ROCHE (CH) 2009-02-18 EP claimed
EP-1523469-B1 CINNAMIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2008-10-08 EP disclosed
CN-1305838-C Cinnamide derivatives HOFFMANN LA ROCHE (CH) 2007-03-21 CN disclosed
CN-1665774-A cinnamide derivative HOFFMANN LA ROCHE (CH) 2005-09-07 CN disclosed
US-6900354-B2 3-phenyl-propionamido, 3-phenyl-acrylamido and 3-phenyl-propynamido derivatives HOFFMAN-LA ROCHE INC. (US) 2005-05-31 US disclosed
EP-1523469-A1 CINNAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2005-04-20 EP disclosed
US-20040034096-A1 3-Phenyl-propionamido, 3-phenyl-acrylamido and 3-phenyl-propynamido derivatives HOFFMANN-LA ROCHE INC. 2004-02-19 US disclosed
WO-2004007429-A1 CINNAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2004-01-22 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-20040034096-A1 3-Phenyl-propionamido, 3-phenyl-acrylamido and 3-phenyl-propynamido derivatives MAOB, MAOA, APP MAOB 1/4885NR4A2 2679/4885PARP10 788/4885

“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.