SCHEMBL2387014

SCHEMBL2387014

CN1CCN(C(=O)c2cccc(-c3cnc(N)c(-c4nc5ccncc5o4)c3)c2)CC1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FYN P06241 1/20 0.59
MET P08581 7/20 0.51
ATR Q13535 1/20 0.47
KCNH2 Q12809 4/20 0.47
PIK3CA P42336 3/20 0.47
MTOR P42345 3/20 0.47
LRRK2 Q5S007 1/20 0.47
GRK5 P34947 1/20 0.47
KDM4E B2RXH2 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PIK3CD O00329 1/20 0.46
ADORA2A P29274 1/20 0.45

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
SCHEMBL2388135 0.93 FYN (0.59) FYNMETATRKCNH2PIK3CA
SCHEMBL2386280 0.85 FYN (0.60) FYNMETATRKCNH2PIK3CA
SCHEMBL2384703 0.85 FYN (0.60) FYNMETATRKCNH2PIK3CA
SCHEMBL2386111 0.81 MET (0.57) METKCNH2
SCHEMBL2387103 0.79 GRK5 (0.49) FYNMETATRGRK5
SCHEMBL2386742 0.79 GRK5 (0.74) FYNATRGRK5PIK3CDADORA2A
SCHEMBL4619233 0.77 FYN (0.74) FYNATRKCNH2PIK3CAMTOR
SCHEMBL2388326 0.76 MET (0.53) METKCNH2GRK5
SCHEMBL2385249 0.75 GRK5 (0.53) FYNMETLRRK2GRK5
SCHEMBL2749343 0.75 FYN (0.62) FYNATRKCNH2PIK3CAMTOR

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-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
US-20090118305-A1 PYRIDINE AND PYRAZINE DERIVATIVES - 083 ASTRAZENECA AB (SE) 2009-05-07 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-20090118305-A1 PYRIDINE AND PYRAZINE DERIVATIVES - 083 MKI67, CCND3, CCND1 FYN 1193/4885MET 2362/4885ATR 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.