SCHEMBL2893455

SCHEMBL2893455

CC(C)(C)Oc1ccc(/C=C/c2ccn(-c3ccc(OC4CCCCO4)cc3)c(=O)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.39
HRH3 Q9Y5N1 2/20 0.33
GPR119 Q8TDV5 1/20 0.33
TNK2 Q07912 3/20 0.32
MCHR1 Q99705 3/20 0.32
KCNH2 Q12809 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
HSD11B1 P28845 1/20 0.30

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
SCHEMBL2893456 1.00 PDE4B (0.39) PDE4BHRH3GPR119TNK2MCHR1
SCHEMBL2893458 0.85 PDE4B (0.37) PDE4BHRH3TNK2MCHR1KCNH2
SCHEMBL2893972 0.78 PTGS2 (0.40) MCHR1MEN1KMT2A
SCHEMBL2893969 0.78 PTGS2 (0.40) MCHR1MEN1KMT2A
SCHEMBL2887433 0.77 MEN1 (0.38) PDE4BHRH3GPR119TNK2MCHR1
SCHEMBL2890476 0.74 MCHR1 (0.55) HRH3MCHR1KCNH2
SCHEMBL2890481 0.74 MCHR1 (0.55) HRH3MCHR1KCNH2
SCHEMBL15224181 0.70 ESR1 (0.54) MEN1KMT2A
SCHEMBL15869163 0.70 TNK2 (0.35) TNK2MEN1KMT2AHSD11B1
SCHEMBL15869172 0.70 TNK2 (0.35) TNK2MEN1KMT2AHSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7732456-B2 Pyridone derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-06-08 US disclosed
US-20070208046-A1 Pyridone derivative MSD K.K. (JP) 2007-09-06 US disclosed
EP-1741703-A1 PYRIDONE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-01-10 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 (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-20070208046-A1 Pyridone derivative CHRM1, XDH, MTR PDE4B 2767/4885HRH3 28/4885GPR119 2063/4885

“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.