SCHEMBL4469189

SCHEMBL4469189

COc1cccc(C(=O)Cn2ccn3c(=O)cc(-c4ccncc4)nc23)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
ALDH1A1 P00352 1/20 0.46
THRB P10828 1/20 0.46
CDYL2 Q8N8U2 4/20 0.45
CDYL Q9Y232 4/20 0.45
CDY1; CDY1B Q9Y6F8 4/20 0.45
GSK3B P49841 6/20 0.45
BRAF P15056 1/20 0.41
ABL1 P00519 1/20 0.41
BCR P11274 1/20 0.41
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
CYP2D6 P10635 1/20 0.41
CBX7 O95931 2/20 0.41
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL4486838 0.86 GSK3B (0.52) ALDH1A1GSK3BCYP2D6
SCHEMBL4483978 0.84 KDM4E (0.44) ALDH1A1CDYL2CDYLCDY1; CDY1BGSK3B
SCHEMBL4491802 0.83 GSK3B (0.44) MAPTALDH1A1GSK3BSMN1; SMN2
SCHEMBL4484628 0.81 GSK3B (0.47) GSK3BSMN1; SMN2
SCHEMBL4473455 0.80 GSK3B (0.42) MAPTALDH1A1GSK3BSMN1; SMN2
SCHEMBL4484716 0.80 GSK3B (0.53) ALDH1A1THRBGSK3BCYP2D6
SCHEMBL4493700 0.78 RARB (0.41) GSK3B
SCHEMBL4001217 0.78 GSK3B (0.48) MAPTALDH1A1THRBGSK3BBRAF
SCHEMBL3996883 0.77 GSK3B (0.47) MAPTALDH1A1THRBGSK3BBRAF
SCHEMBL4873809 0.76 MAPT (0.43) MAPTALDH1A1THRBCDYL2CDYL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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
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
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 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 MAPT 54/4885ALDH1A1 259/4885THRB 2451/4885

“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.