SCHEMBL2386302

SCHEMBL2386302

COC(=O)c1cc(-c2cnn(C3CCN(C)CC3)c2)cnc1N

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MERTK Q12866 8/20 0.59
AXL P30530 6/20 0.59
MAP4K3 Q8IVH8 1/20 0.55
FGFR1 P11362 3/20 0.53
FGFR2 P21802 3/20 0.53
FGFR3 P22607 3/20 0.53
NTRK1 P04629 1/20 0.52
MET P08581 4/20 0.49
WNT1 P04628 1/20 0.47
GSK3B P49841 1/20 0.47
DYRK1A Q13627 1/20 0.47
IKBKE Q14164 1/20 0.47
TBK1 Q9UHD2 1/20 0.47
PAK1 Q13153 1/20 0.47
BMPR1A P36894 1/20 0.46
ACVRL1 P37023 1/20 0.46
ACVR1 Q04771 1/20 0.46
TYRO3 Q06418 1/20 0.46

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
SCHEMBL18615853 0.88 AXL (0.57) MERTKAXLMAP4K3FGFR1FGFR2
SCHEMBL2386565 0.88 AXL (0.59) MERTKAXLMAP4K3FGFR1FGFR2
SCHEMBL2387035 0.87 MAP4K3 (0.68) MERTKAXLMAP4K3NTRK1MET
SCHEMBL2386492 0.87 AXL (0.56) MERTKAXLMAP4K3FGFR1FGFR2
Hydrochloric Acid SCHEMBL2385615 0.87 AXL (0.59) MERTKAXLMAP4K3FGFR1FGFR2
Hydrochloric Acid SCHEMBL2386496 0.87 AXL (0.59) MERTKAXLMAP4K3FGFR1FGFR2
SCHEMBL2385504 0.86 MET (0.53) MERTKAXLMAP4K3FGFR1FGFR2
SCHEMBL18591563 0.81 IKBKE (0.62) MERTKAXLMETIKBKETBK1
SCHEMBL2388397 0.81 AXL (0.56) MERTKAXLMAP4K3FGFR1FGFR2
SCHEMBL2387892 0.81 MERTK (0.57) MERTKAXLMAP4K3FGFR1FGFR2

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 MERTK 3823/4885AXL 2302/4885MAP4K3 102/4885

“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.