SCHEMBL2893458

SCHEMBL2893458

CC(C)COc1ccc(C=Cc2ccn(-c3ccc(OC4CCCCO4)cc3)c(=O)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.37
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
MCHR1 Q99705 3/20 0.34
KCNH2 Q12809 2/20 0.34
HPGD P15428 2/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
TNK2 Q07912 1/20 0.32
APP P05067 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32

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
SCHEMBL2893455 0.85 PDE4B (0.39) PDE4BMEN1KMT2AMCHR1KCNH2
SCHEMBL2893456 0.85 PDE4B (0.39) PDE4BMEN1KMT2AMCHR1KCNH2
SCHEMBL2893975 0.78 CHRNB2 (0.41) MCHR1KCNH2
SCHEMBL2890484 0.77 MCHR1 (0.55) KMT2AMCHR1KCNH2APPHRH3
SCHEMBL2887433 0.74 MEN1 (0.38) PDE4BMEN1KMT2AMCHR1KCNH2
SCHEMBL2892007 0.71 MCHR1 (0.62) MCHR1KCNH2
SCHEMBL2895097 0.70 MCHR1 (0.59) MCHR1KCNH2HRH3
SCHEMBL1070597 0.69 MEN1 (0.51) MEN1KMT2AKCNH2HPGDMAOA
SCHEMBL1070599 0.69 MEN1 (0.51) MEN1KMT2AKCNH2HPGDMAOA
SCHEMBL2891194 0.69 MCHR1 (0.55) MCHR1KCNH2HRH3

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 2767/4885MEN1 616/4885KMT2A 2416/4885

“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.