SCHEMBL2385199

SCHEMBL2385199

Nc1ncc(-c2cccc3ccccc23)cc1-c1nc2ccccc2o1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MET P08581 14/20 0.65
ALDH1A1 P00352 3/20 0.56
MAPT P10636 3/20 0.56
HPGD P15428 3/20 0.56
HSD17B10 Q99714 2/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
KCNH2 Q12809 2/20 0.52
AXL P30530 1/20 0.52
ESR1 P03372 1/20 0.50
ESR2 Q92731 1/20 0.50
KDM4E B2RXH2 2/20 0.46
GAA P10253 1/20 0.46
USP2 O75604 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
ATM Q13315 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
SCHEMBL13625192 0.88 MET (0.66) METALDH1A1MAPTHPGDHSD17B10
SCHEMBL2388476 0.87 MET (0.67) METALDH1A1MAPTHPGDHSD17B10
SCHEMBL2388942 0.85 MET (0.65) METALDH1A1HPGDHSD17B10MEN1
SCHEMBL2387588 0.84 MET (0.73) METMEN1KMT2AKCNH2AXL
SCHEMBL12232045 0.81 ALDH1A1 (0.46) METALDH1A1MAPTHPGDHSD17B10
SCHEMBL987895 0.80 ALDH1A1 (0.68) ALDH1A1MAPTHPGDHSD17B10MEN1
SCHEMBL29531231 0.80 ALDH1A1 (0.68) ALDH1A1MAPTHPGDHSD17B10MEN1
SCHEMBL2387593 0.80 MET (0.71) METALDH1A1HPGDHSD17B10MEN1
SCHEMBL27281773 0.79 ALDH1A1 (0.59) ALDH1A1MAPTHPGDHSD17B10MEN1
SCHEMBL30022809 0.78 ALDH1A1 (0.66) ALDH1A1MAPTHPGDHSD17B10MEN1

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 6 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
CN-101910158-A Pyridine and pyrazine derivatives useful in the treatment of cell proliferative disorders ASTRAZENECA AB 2010-12-08 CN 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 2362/4885ALDH1A1 802/4885MAPT 2946/4885

“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.