SCHEMBL1878359

SCHEMBL1878359

Cn1c(=O)c(Br)nc2cnn(-c3c(F)cccc3F)c21

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.47
MAPKAPK2 P49137 2/20 0.41
MAPK13 O15264 1/20 0.41
RAF1 P04049 1/20 0.41
PDGFRA P16234 1/20 0.41
MAPK12 P53778 1/20 0.41
KCNH2 Q12809 1/20 0.41
MAPK11 Q15759 1/20 0.41
PDE7A Q13946 2/20 0.34
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
PDE7B Q9NP56 1/20 0.34
PKM P14618 1/20 0.32
HDAC9 Q9UKV0 1/20 0.32

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
SCHEMBL1884315 0.79 MAPK14 (0.57) MAPK14MAPKAPK2MAPK13RAF1PDGFRA
SCHEMBL1883322 0.79 MAPK14 (0.44) MAPK14MAPKAPK2
SCHEMBL1878872 0.72 HCAR1 (0.39) MAPK14HDAC9
SCHEMBL1880265 0.71 MAPK14 (0.73) MAPK14MAPKAPK2MAPK13RAF1PDGFRA
SCHEMBL3668107 0.68 MAPK14 (0.47) MAPK14MAPKAPK2MAPK13RAF1PDGFRA
SCHEMBL1882664 0.68 MAPK14 (0.34) MAPK14HDAC9
SCHEMBL4092033 0.66 MAPK14 (0.55) MAPK14MAPKAPK2MAPK13RAF1PDGFRA
SCHEMBL3767381 0.66 MAPK14 (0.65) MAPK14MAPKAPK2MAPK13RAF1PDGFRA
SCHEMBL3757488 0.66 MAPK14 (0.65) MAPK14MAPKAPK2MAPK13RAF1PDGFRA
SCHEMBL3671305 0.65 MAPK14 (0.60) MAPK14MAPKAPK2MAPK13RAF1PDGFRA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8367671-B2 Pyrazolo[3.4-B]pyrazine compounds as p38 modulators and methods of use as anti-inflamatory agents AMGEN INC. (US) 2013-02-05 US disclosed
US-20110105499-A1 Pyrazolo-Pyrazinone Compounds and Methods of Use Thereof AMGEN INC. (US) 2011-05-05 US disclosed
WO-2009117156-A1 PYRAZOLO-PYRAZINONE COMPOUNDS AND METHODS OF USE THEREOF AMGEN INC. (US) 2009-09-24 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-20110105499-A1 Pyrazolo-Pyrazinone Compounds and Methods of Use Thereof MAPK1, MAP3K1, MAP4K2 MAPK14 32/4885MAPKAPK2 28/4885MAPK13 43/4885

“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.