SCHEMBL5778685

SCHEMBL5778685

Nc1nc2cccnc2n1-c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 10/20 0.51
AKT2 P31751 5/20 0.50
PDE4B Q07343 1/20 0.49
AKT3 Q9Y243 3/20 0.46
HCAR1 Q9BXC0 1/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
POLB P06746 1/20 0.45
PABPC1 P11940 1/20 0.45
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.43
TSHR P16473 1/20 0.43
CYP2C19 P33261 1/20 0.43
MAPT P10636 1/20 0.43
LMNA P02545 1/20 0.42

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
SCHEMBL21316851 0.79 PDE4B (0.49) AKT1AKT2PDE4BAKT3MEN1
SCHEMBL540893 0.79 MAPK1 (0.59) AKT1AKT2PDE4BMEN1KMT2A
SCHEMBL2176676 0.79 AKT1 (0.82) AKT1AKT2AKT3
SCHEMBL30931249 0.79 AKT1 (0.42) AKT1AKT2PDE4BAKT3MEN1
SCHEMBL10051902 0.79 AKT1 (0.65) AKT1AKT2PDE4BAKT3MEN1
SCHEMBL804897 0.78 ALDH1A1 (0.60) AKT1AKT2PDE4BAKT3MEN1
SCHEMBL8805096 0.78 ALDH1A1 (0.64) AKT1AKT2PDE4BAKT3HCAR1
SCHEMBL21681303 0.77 AKT1 (0.43) AKT1AKT2PDE4BAKT3MEN1
SCHEMBL13916708 0.77 ALDH1A1 (0.58) AKT1AKT2PDE4BAKT3MEN1
SCHEMBL13314063 0.77 AKT1 (0.52) AKT1AKT2PDE4BAKT3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7098220-B2 Imidazopyridine derivatives, preparation method and pharmaceutical compositions containing same LES LABORATOIRES SERVIER (FR) 2006-08-29 US disclosed
EP-1558612-B1 IMIDAZOPYRIDINE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SERVIER LAB (FR) 2006-08-23 EP disclosed
US-20060069117-A1 Imidazopyridine derivatives, preparation method and pharmaceutical compositions containing same LES LABORATOIRES SERVIER (FR) 2006-03-30 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-20060069117-A1 Imidazopyridine derivatives, preparation method and pharmaceutical compositions containing same PRKAA1, PRKAB1, PRKAB2 AKT1 474/4885AKT2 558/4885PDE4B 1257/4885

“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.