SCHEMBL88461

SCHEMBL88461

Cn1c(N2CCC3(CC2)CN(C(=O)OC(C)(C)C)Cc2ccccc23)nc(-c2ccncc2F)cc1=O

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.44
GSK3B P49841 7/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
NAMPT P43490 6/20 0.37
CYP11B2 P19099 1/20 0.36
USP30 Q70CQ3 1/20 0.34
AVPR1A P37288 1/20 0.34

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
SCHEMBL87907 0.85 GSK3B (0.49) GSK3BCYP1A2CYP2D6
SCHEMBL88150 0.82 GSK3B (0.47) GPR119GSK3BCYP1A2CYP2D6
SCHEMBL87938 0.80 GSK3B (0.51) GSK3BCYP1A2CYP2D6
SCHEMBL88136 0.78 GSK3B (0.49) GSK3BCYP1A2CYP2D6
SCHEMBL8232956 0.76 GSK3B (0.59) GPR119GSK3BCYP1A2CYP2D6
SCHEMBL88139 0.76 GSK3B (0.51) GSK3BCYP1A2CYP2D6
SCHEMBL17969880 0.73 MAPK1 (0.50) GPR119NAMPTCYP11B2USP30
SCHEMBL88101 0.72 GSK3B (0.51) GSK3BCYP1A2CYP2D6
SCHEMBL30561535 0.71 MAPK1 (0.51) GPR119NAMPTUSP30
SCHEMBL8268075 0.71 GSK3B (0.63) GSK3BCYP1A2CYP2D6

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
US-8129377-B2 6-(pyridinyl)-4-pyrimidone derivates as tau protein kinase 1 inhibitors MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-03-06 US disclosed
US-8129377-B2 6-(pyridinyl)-4-pyrimidone derivates as tau protein kinase 1 inhibitors MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-03-06 US disclosed
US-20090239864-A1 6- (PYRIDINYL) -4-PYRIMIDONE DERIVATES AS TAU PROTEIN KINASE 1 INHIBITORS MITSUBISHI PHARMA CORPORATION (JP) 2009-09-24 US disclosed
US-20090239864-A1 6- (PYRIDINYL) -4-PYRIMIDONE DERIVATES AS TAU PROTEIN KINASE 1 INHIBITORS MITSUBISHI PHARMA CORPORATION (JP) 2009-09-24 US disclosed
WO-2006036015-A2 6- (PYRIDINYL) -4-PYRIMIDONE DERIVATES AS TAU PROTEIN KINASE 1 INHIBITORS MITSUBISHI PHARMA CORPORATION (JP) 2006-04-06 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-20090239864-A1 6- (PYRIDINYL) -4-PYRIMIDONE DERIVATES AS TAU PROTEIN KINASE 1 INHIBITORS MAPT, TTBK1, PSEN1 GPR119 1586/4885GSK3B 89/4885CYP1A2 1897/4885

“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.