SCHEMBL88268

SCHEMBL88268

Cn1c(N2CCO[C@@H](c3ccc(OCCCN4CCOCC4)cc3)C2)nc(-c2ccncc2F)cc1=O

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 19/20 0.73
CYP2D6 P10635 13/20 0.73
CYP1A2 P05177 9/20 0.73
CSNK1A1 P48729 1/20 0.56
GSK3A P49840 1/20 0.56

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
SCHEMBL83234 0.96 GSK3B (0.74) GSK3BCYP2D6CYP1A2CSNK1A1GSK3A
Hydrochloric Acid SCHEMBL83402 0.95 GSK3B (0.73) GSK3BCYP2D6CYP1A2CSNK1A1GSK3A
SCHEMBL88050 0.95 GSK3B (0.74) GSK3BCYP2D6CYP1A2CSNK1A1GSK3A
SCHEMBL88572 0.94 GSK3B (0.73) GSK3BCYP2D6CYP1A2CSNK1A1GSK3A
SCHEMBL88288 0.94 GSK3B (0.73) GSK3BCYP2D6CYP1A2CSNK1A1GSK3A
SCHEMBL82685 0.91 GSK3B (0.75) GSK3BCYP2D6CYP1A2CSNK1A1GSK3A
SCHEMBL5540258 0.90 GSK3B (0.74) GSK3BCYP2D6CYP1A2CSNK1A1GSK3A
SCHEMBL83600 0.90 GSK3B (0.74) GSK3BCYP2D6CYP1A2CSNK1A1GSK3A
SCHEMBL83624 0.90 GSK3B (0.74) GSK3BCYP2D6CYP1A2CSNK1A1GSK3A
SCHEMBL13018962 0.90 GSK3B (0.73) GSK3BCYP2D6CYP1A2CSNK1A1GSK3A

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-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

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 GSK3B 89/4885CYP2D6 1266/4885CYP1A2 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.