SCHEMBL4451899

SCHEMBL4451899

COc1ccc(Cl)cc1NC(=O)N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 10/20 0.67
MAPT P10636 3/20 0.66
MAPK1 P28482 1/20 0.61
LMNA P02545 1/20 0.57
KCNT1 Q5JUK3 2/20 0.56
STS P08842 1/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
THRB P10828 1/20 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
SCHEMBL4306582 0.84 MAPT (0.73) RBP4MAPTMAPK1LMNAKCNT1
SCHEMBL5457870 0.82 RBP4 (0.58) RBP4MAPTMAPK1LMNAMEN1
SCHEMBL16690848 0.82 RBP4 (0.83) RBP4MAPTMAPK1LMNAKCNT1
SCHEMBL6106954 0.82 GPR119 (0.62) RBP4MAPTLMNASTSMEN1
SCHEMBL6107730 0.81 MEN1 (0.55) RBP4MAPTSTSMEN1KMT2A
SCHEMBL12632946 0.81 CYP2C9 (0.58) RBP4MAPTLMNASTSMEN1
SCHEMBL16690804 0.81 RBP4 (1.00) RBP4MAPTMAPK1LMNAKMT2A
SCHEMBL4301167 0.80 MAPT (0.67) RBP4MAPTMAPK1LMNAKCNT1
SCHEMBL16690825 0.79 RBP4 (1.00) RBP4MAPTMAPK1LMNAKCNT1
SCHEMBL4307202 0.79 MAPK1 (0.77) RBP4MAPTMAPK1LMNAKCNT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090118303-A1 SEROTONIN 5-HT3 RECEPTOR AGONIST RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2009-05-07 US disclosed
US-7485646-B2 Serotonin 5-HT3 receptor agonist RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2009-02-03 US disclosed
US-20070265277-A1 Serotonin 5-Ht3 Receptor Agonist RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2007-11-15 US disclosed
EP-1798227-A1 SEROTONIN 5-HT3 RECEPTOR AGONIST Research Foundation Itsuu Laboratory (JP) 2007-06-20 EP 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 (2 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-20090118303-A1 SEROTONIN 5-HT3 RECEPTOR AGONIST HTR3A, HTR7, HTR1A RBP4 3590/4885MAPT 4268/4885MAPK1 1292/4885
US-20070265277-A1 Serotonin 5-Ht3 Receptor Agonist HTR3A, HTR7, HTR1A RBP4 3590/4885MAPT 4268/4885MAPK1 1292/4885

“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.