SCHEMBL2384401

SCHEMBL2384401

Nc1ncc(-c2ccc(C(=O)NCCO)cc2)cc1-c1nc2cccnc2o1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRK5 P34947 1/20 0.48
FYN P06241 3/20 0.47
ATR Q13535 2/20 0.45
MET P08581 4/20 0.45
MAPK1 P28482 1/20 0.43
MAP4K4 O95819 3/20 0.43
CHEK2 O96017 3/20 0.42
MKNK1 Q9BUB5 1/20 0.42
AKT1 P31749 1/20 0.41
AKT2 P31751 1/20 0.41
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MINK1 Q8N4C8 1/20 0.39
TNIK Q9UKE5 1/20 0.39

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
SCHEMBL2387896 0.90 L3MBTL1 (0.52) GRK5FYNMETCHEK2KDM4E
SCHEMBL2384953 0.89 PRKD3 (0.51) GRK5FYNMETMAP4K4CHEK2
SCHEMBL2387793 0.85 FYN (0.47) GRK5FYNMETMAPK1MAP4K4
SCHEMBL2386462 0.84 MAP4K4 (0.58) METMAP4K4CHEK2MKNK1
SCHEMBL2387752 0.83 MET (0.52) GRK5FYNATRMETMAPK1
SCHEMBL2385733 0.83 PIK3CD (0.49) FYNMETMAP4K4MINK1TNIK
SCHEMBL2387166 0.81 PRKD3 (0.60) GRK5FYNMAP4K4CHEK2MKNK1
SCHEMBL2388009 0.80 MET (0.55) GRK5FYNMETMAP4K4CHEK2
SCHEMBL2386088 0.80 GRK5 (0.54) GRK5FYNMETMAPK1MAP4K4
SCHEMBL2384991 0.79 GRK5 (0.68) GRK5FYNATRMAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8017611-B2 Pyridine and pyrazine derivatives -083 ASTRAZENECA AB (SE) 2011-09-13 US disclosed
EP-2215085-B1 PYRIDINE AND PYRAZINE DERIVATIVES USEFUL IN THE TREATMENT OF CELL PROLIFERATIVE DISORDERS ASTRAZENECA AB (SE) 2011-09-07 EP disclosed
EP-2215085-A2 PYRIDINE AND PYRAZINE DERIVATIVES USEFUL IN THE TREATMENT OF CELL PROLIFERATIVE DISORDERS AstraZeneca AB (SE) 2010-08-11 EP disclosed
US-20090118305-A1 PYRIDINE AND PYRAZINE DERIVATIVES - 083 ASTRAZENECA AB (SE) 2009-05-07 US disclosed
WO-2009053737-A2 PYRIDINE AND PYRAZINE DERIVATIVES USEFUL IN THE TREATMENT OF CELL PROLIFERATIVE DISORDERS ASTRAZENECA AB (SE) 2009-04-30 WO 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-20090118305-A1 PYRIDINE AND PYRAZINE DERIVATIVES - 083 MKI67, CCND3, CCND1 GRK5 579/4885FYN 1193/4885ATR 1304/4885

“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.