SCHEMBL4587227

SCHEMBL4587227

O=c1cc(-c2ncccn2)nc2[nH]ccn12

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
GFER P55789 1/20 0.35
RAD51 Q06609 1/20 0.32
GRM5 P41594 1/20 0.32
ADORA3 P0DMS8 1/20 0.30

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
SCHEMBL4484234 0.77 KDM5B (0.47) KDM5BKDM4EALDH1A1HPGDGFER
SCHEMBL4586569 0.77 GSK3B (0.44)
SCHEMBL6021715 0.71 BRD4 (0.31)
SCHEMBL3325823 0.62 KDM4E (0.47) KDM5BKDM4EALDH1A1HPGD
SCHEMBL7015921 0.61 KDM4E (0.54) KDM4EALDH1A1HPGD
SCHEMBL11779144 0.61 KDM4E (0.39) KDM4EALDH1A1HPGD
SCHEMBL18210595 0.60 AXL (0.44) KDM4EALDH1A1GRM5
SCHEMBL18776508 0.60 KDM4E (0.30) KDM4EALDH1A1
SCHEMBL30473299 0.60 ADORA3 (0.36) ADORA3
SCHEMBL10994895 0.60 KDM4E (0.43) KDM5BKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1480981-B1 1-(ALKYL), 1-(HETEROARYL)ALKYL AND 1-[(ARYL)ALKYL]-7-(PYRIMIDIN-4-YL)-IMIDAZO[1,2-A]PYRIMIDIN-5(1H)-ONE DERIVATIVES SANOFI AVENTIS (FR) 2005-11-09 EP claimed
US-20050119280-A1 1-[alkyl 1-[heteroaryl )alkyl] and 1-[ aryl) alkyl]-7-( pyrimidin-4-yl) imadazo [1,2-a] pyrimidin-5(1h)-one derivatives SANOFI (FR) 2005-06-02 US claimed
EP-1480981-A1 1-(ALKYL), 1-(HETEROARYL)ALKYL AND 1-[(ARYL)ALKYL]-7-(PYRIMIDIN-4-YL)-IMIDAZO[1,2-A]PYRIMIDIN-5(1H)-ONE DERIVATIVES Sanofi-Aventis (FR) 2004-12-01 EP claimed
WO-2003072580-A1 1-[ALKYL], 1-[HETEROARYL)ALKYL] AND 1-[ARYL)ALKYL]-7-(PYRIMIDIN-4-YL)-IMADAZO[1,2-a]PYRIMIDIN-5(1H)-ONE DERIVATIVES SANOFI-AVENTIS (FR) 2003-09-04 WO claimed
US-20080318980-A1 USE OF 7-(PYRIMIDIN-4 YL)-IMIDAZO[1,2-a]PYRIMIDIN-5(1H)-ONES AS GSK-3BETA INHIBITORS SANOFI-AVENTIS (FR) 2008-12-25 US disclosed
US-7429663-B2 7-(Pyrimidin-4-yl)-Imidazo[1,2-a]Pyrimidin-5(1H)-ones as GSK3β inhibitors SANOFI-AVENTIS (FR) 2008-09-30 US disclosed
EP-1480981-B1 1-(ALKYL), 1-(HETEROARYL)ALKYL AND 1-[(ARYL)ALKYL]-7-(PYRIMIDIN-4-YL)-IMIDAZO[1,2-A]PYRIMIDIN-5(1H)-ONE DERIVATIVES SANOFI AVENTIS (FR) 2005-11-09 EP disclosed
US-20050119280-A1 1-[alkyl 1-[heteroaryl )alkyl] and 1-[ aryl) alkyl]-7-( pyrimidin-4-yl) imadazo [1,2-a] pyrimidin-5(1h)-one derivatives SANOFI (FR) 2005-06-02 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 (2 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-20080318980-A1 USE OF 7-(PYRIMIDIN-4 YL)-IMIDAZO[1,2-a]PYRIMIDIN-5(1H)-ONES AS GSK-3BETA INHIBITORS GSK3B, GSK3A, PSEN1 KDM5B 1320/4885KDM4E 1428/4885ALDH1A1 1041/4885
US-20050119280-A1 1-[alkyl 1-[heteroaryl )alkyl] and 1-[ aryl) alkyl]-7-( pyrimidin-4-yl) imadazo [1,2-a] pyrimidin-5(1h)-one derivatives PSEN1, GSK3A, GSK3B KDM5B 2913/4885KDM4E 2616/4885ALDH1A1 130/4885

“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.