SCHEMBL2491589

SCHEMBL2491589

CCN(c1nc(-c2ccncc2)cc(=O)n1C)C1CCN(C(=O)Cc2ccccc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 15/20 0.47
L3MBTL1 Q9Y468 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
CYP46A1 Q9Y6A2 1/20 0.38
CYP2C9 P11712 1/20 0.38
HSD11B1 P28845 1/20 0.38

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
SCHEMBL2489981 0.97 GSK3B (0.44) GSK3BL3MBTL1CYP1A2CYP2D6CYP2C9
SCHEMBL2489073 0.90 GSK3B (0.44) GSK3BCYP1A2CYP2D6
SCHEMBL2486230 0.88 GSK3B (0.45) GSK3BL3MBTL1CYP1A2CYP2D6
SCHEMBL2489124 0.88 GSK3B (0.47) GSK3BCYP1A2CYP2D6
SCHEMBL2491329 0.88 GSK3B (0.48) GSK3BCYP1A2CYP2D6CYP2C9
SCHEMBL2489453 0.86 GSK3B (0.42) GSK3BCYP1A2CYP2D6
SCHEMBL2491312 0.85 GSK3B (0.49) GSK3BCYP1A2CYP2D6
SCHEMBL2526541 0.84 GSK3B (0.45) GSK3BCYP1A2CYP2D6CYP2C9
SCHEMBL2491214 0.84 GSK3B (0.43) GSK3BCYP2D6
SCHEMBL2488825 0.84 GSK3B (0.46) GSK3BCYP1A2CYP2D6CYP2C9

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-2057141-B1 PYRIMIDONE COMPOUNDS AS GSK-3 INHIBITORS PFIZER PROD INC (US) 2011-10-26 EP disclosed
US-20100292205-A1 Pyrimidone Compounds As GSK-3 Inhibitors PFIZER INC. (US) 2010-11-18 US disclosed
US-20100292205-A1 Pyrimidone Compounds As GSK-3 Inhibitors PFIZER INC. (US) 2010-11-18 US disclosed
US-20100292205-A1 Pyrimidone Compounds As GSK-3 Inhibitors PFIZER INC. (US) 2010-11-18 US disclosed
WO-2008023239-A1 PYRIMIDONE COMPOUNDS AS GSK-3 INHIBITORS PFIZER PRODUCTS INC. (US) 2008-02-28 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-20100292205-A1 Pyrimidone Compounds As GSK-3 Inhibitors GSK3B, GSK3A, GSKIP GSK3B 1/4885L3MBTL1 3354/4885CYP1A2 1200/4885

“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.