SCHEMBL4493476

SCHEMBL4493476

CC1(C)CCC(C)(C)c2cc(C(O)Cn3ccn4c(=O)cc(-c5ccncc5)nc34)ccc21

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP26B1 Q9NR63 1/20 0.38
GSK3B P49841 8/20 0.38
RXRA P19793 2/20 0.35
RARA P10276 7/20 0.35
RARB P10826 7/20 0.35
RARG P13631 6/20 0.35
RXRB P28702 1/20 0.33
PIK3CD O00329 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
PIK3CG P48736 1/20 0.31

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
SCHEMBL4564854 0.82 GSK3B (0.42) CYP3A4GSK3BPIK3CDPIK3CAPIK3CB
SCHEMBL4496412 0.81 GSK3B (0.41) GSK3BPIK3CDPIK3CAPIK3CB
SCHEMBL4493700 0.80 RARB (0.41) CYP26A1CYP3A4CYP26B1GSK3BRXRA
SCHEMBL4000987 0.78 GSK3B (0.38) CYP26A1CYP3A4CYP26B1GSK3BRXRA
SCHEMBL4564852 0.73 GSK3B (0.40) GSK3BPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL4587769 0.69 GSK3B (0.40) GSK3B
SCHEMBL4483107 0.68 GSK3B (0.38) GSK3BPIK3CDPIK3CB
SCHEMBL4489695 0.68 GSK3B (0.38) GSK3BPIK3CDPIK3CB
SCHEMBL4483112 0.68 GSK3B (0.38) GSK3BPIK3CDPIK3CB
SCHEMBL4473700 0.67 GSK3B (0.55) GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060148825-A1 1-[Alkyl], 1-[(heteroaryl) alkyl] and 1-[(Aryl)alkyl]-7-pyridinyl-imidazo[1,2-a]pyrimidin-5(1H)-one derivatives SANOFI-AVENTIS (FR) 2006-07-06 US claimed
US-7067521-B2 1-[alkyl], 1-[(heteroaryl)alkyl] and 1-[(aryl)alkyl]-7pyridinyl-imidazo[1,2-alpha]pyrimidin-5(1H)-one derivatives SANOFI-AVENTIS (FR) 2006-06-27 US claimed
EP-1315730-B1 1-(ALKYL), 1-[(HETEROARYL)ALKYL] AND 1-[(ARYL)ALKYL]-7-PYRIDINYL-IMIDAZO(1,2-A)PYRIMIDIN-5(1H)-ONE DERIVATIVES SANOFI SYNTHELABO (FR) 2004-06-30 EP claimed
US-7608624-B2 1-[alkyl], 1-[(heteroaryl)alkyl] and 1-[(aryl)alkyl]-7-pyridinyl-imidazo[1,2-a]pyrimidin-5(1h)-one derivatives SANOFI-AVENTIS (FR) 2009-10-27 US disclosed
US-20060148825-A1 1-[Alkyl], 1-[(heteroaryl) alkyl] and 1-[(Aryl)alkyl]-7-pyridinyl-imidazo[1,2-a]pyrimidin-5(1H)-one derivatives SANOFI-AVENTIS (FR) 2006-07-06 US disclosed
EP-1315730-B1 1-(ALKYL), 1-[(HETEROARYL)ALKYL] AND 1-[(ARYL)ALKYL]-7-PYRIDINYL-IMIDAZO(1,2-A)PYRIMIDIN-5(1H)-ONE DERIVATIVES SANOFI SYNTHELABO (FR) 2004-06-30 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-20060148825-A1 1-[Alkyl], 1-[(heteroaryl) alkyl] and 1-[(Aryl)alkyl]-7-pyridinyl-imidazo[1,2-a]pyrimidin-5(1H)-one derivatives PSEN1, PSEN2, SNCA CYP26A1 799/4885CYP3A4 2886/4885CYP26B1 1994/4885

“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.