SCHEMBL2385709

SCHEMBL2385709

Nc1ncc(-c2cccc(CN3CCCCC3)c2)cc1-c1nc2cnccc2o1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 3/20 0.51
MET P08581 10/20 0.51
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
GRK5 P34947 4/20 0.41
GRK2 P25098 3/20 0.41
KCNH2 Q12809 2/20 0.40

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
SCHEMBL2384888 0.99 LRRK2 (0.52) LRRK2METNPC1RAB9AGRK5
SCHEMBL2384685 0.92 LRRK2 (0.52) LRRK2METGRK5GRK2KCNH2
SCHEMBL2388544 0.89 MET (0.57) LRRK2METKCNH2
SCHEMBL2386843 0.85 MET (0.58) LRRK2METNPC1GRK5KCNH2
SCHEMBL2387559 0.84 LRRK2 (0.52) LRRK2METNPC1RAB9A
SCHEMBL2388959 0.84 LRRK2 (0.52) LRRK2METGRK5
SCHEMBL2386610 0.84 MET (0.53) METGRK5GRK2KCNH2
SCHEMBL2387340 0.83 LRRK2 (0.53) LRRK2METNPC1RAB9A
SCHEMBL2387184 0.83 LRRK2 (0.53) LRRK2METGRK5
SCHEMBL2388522 0.81 LRRK2 (0.60) LRRK2METGRK5GRK2

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 LRRK2 1684/4885MET 2362/4885NPC1 2864/4885

“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.