SCHEMBL2385455

SCHEMBL2385455

Nc1ncc(Br)cc1-c1nc2cccc(F)c2o1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MET P08581 8/20 0.41
GRK5 P34947 2/20 0.39
ESR1 P03372 2/20 0.39
ESR2 Q92731 1/20 0.39
F2RL3 Q96RI0 2/20 0.38
C1R P00736 1/20 0.37
RPS6KA2 Q15349 1/20 0.35
KMT2A Q03164 2/20 0.35
HTT P42858 1/20 0.35
GRK2 P25098 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
AKT1 P31749 1/20 0.34
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
XBP1 P17861 1/20 0.34
HIF1A Q16665 1/20 0.34

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
SCHEMBL2386739 0.85 ESR2 (0.39) METGRK5ESR1ESR2KMT2A
SCHEMBL2386305 0.81 ESR1 (0.40) METGRK5ESR1ESR2KMT2A
SCHEMBL2384705 0.81 KDM4E (0.44) METGRK5ESR1ESR2C1R
SCHEMBL2386983 0.80 MET (0.41) METGRK5ESR1KMT2AHTT
SCHEMBL2386058 0.79 C1R (0.43) METGRK5F2RL3C1RRPS6KA2
SCHEMBL2384707 0.79 MET (0.63) METKMT2ASMN1; SMN2MAPTKDM4E
SCHEMBL2387190 0.77 CETP (0.44) METGRK5ESR2KMT2AMAPT
SCHEMBL2387852 0.76 MET (0.45) METGRK5KMT2AHTTSMN1; SMN2
SCHEMBL2386346 0.75 MAPT (0.48) METGRK5ESR1ESR2KMT2A
SCHEMBL29857589 0.71 KMT2A (0.46) METKMT2AHTTSMN1; SMN2MAPT

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 2362/4885GRK5 579/4885ESR1 2825/4885

“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.