SCHEMBL2387128

SCHEMBL2387128

COc1cc(N2CCNCC2)ccc1-c1cnc(N)c(-c2nc3ccccc3o2)c1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MET P08581 5/20 0.55
KCNH2 Q12809 2/20 0.55
GRK2 P25098 6/20 0.54
GRK5 P34947 6/20 0.54
ALK Q9UM73 2/20 0.54
TGFBR1 P36897 7/20 0.52
ACVR1 Q04771 6/20 0.52
AXL P30530 1/20 0.51
FYN P06241 1/20 0.50

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
SCHEMBL2386250 0.86 MET (0.55) METKCNH2GRK2GRK5ALK
SCHEMBL2388637 0.85 TGFBR1 (0.63) METKCNH2GRK2GRK5ALK
SCHEMBL2386643 0.83 TGFBR1 (0.64) METKCNH2GRK2GRK5ALK
SCHEMBL13625128 0.82 MET (0.56) METKCNH2GRK2GRK5ALK
SCHEMBL2386003 0.79 MET (0.61) METKCNH2GRK2GRK5ALK
SCHEMBL2385402 0.78 FYN (0.49) METGRK2GRK5ALKTGFBR1
SCHEMBL27829972 0.77 MET (0.66) METKCNH2GRK2GRK5
SCHEMBL2384952 0.77 MET (0.60) METKCNH2GRK2GRK5ALK
SCHEMBL27829953 0.76 MET (0.70) METKCNH2GRK2GRK5AXL
SCHEMBL2385786 0.76 MET (0.59) METKCNH2GRK2GRK5ALK

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 MET 2362/4885KCNH2 833/4885GRK2 1189/4885

“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.