SCHEMBL3673264

SCHEMBL3673264

O=c1c(Br)cc2cnn(-c3ccc(F)cc3F)c2n1CC(O)CO

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 0.42
CYP3A4 P08684 1/20 0.42
MAP2K1 Q02750 2/20 0.38
LCK P06239 1/20 0.38
KIT P10721 1/20 0.38
KDR P35968 1/20 0.38
MAPKAPK2 P49137 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
TSHR P16473 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
GAA P10253 1/20 0.31

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
SCHEMBL3671793 0.80 MAPK14 (0.42) MAPK14CYP3A4LCKKITKDR
SCHEMBL3666224 0.74 MAPK14 (0.81) MAPK14CYP3A4LCKKITKDR
SCHEMBL3770447 0.67 TP53 (0.40) MAPK14CYP3A4LCKKITKDR
SCHEMBL1883322 0.67 MAPK14 (0.44) MAPK14CYP3A4LCKKITKDR
SCHEMBL1878339 0.64 MAPK14 (0.46) MAPK14CYP3A4LCKKITKDR
SCHEMBL30568558 0.63 CYP11B2 (0.40) MAPK14GAA
SCHEMBL29703261 0.63 NPC1 (0.54) L3MBTL1
SCHEMBL1877849 0.62 MAPK14 (0.47) MAPK14CYP3A4LCKKITKDR
SCHEMBL14966292 0.61 CYP17A1 (0.41) MAPK14CYP3A4LCKKITKDR
SCHEMBL9665772 0.60 RAB9A (0.50) MAPK14CYP3A4L3MBTL1CYP2C19GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7846944-B2 Pyrazolo-pyridinone compounds and methods of use thereof AMGEN INC. (US) 2010-12-07 US disclosed
EP-2152704-A1 PYRAZOLO-PYRIDINONE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND THEIR PHARMACEUTICAL USE Amgen, Inc (US) 2010-02-17 EP disclosed
US-20090012299-A1 Pyrazolo-pyridinone compounds and methods of use thereof AMGEN INC. (US) 2009-01-08 US disclosed
WO-2008137176-A1 PYRAZOLO-PYRIDINONE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND THEIR PHARMACEUTICAL USE AMGEN INC. (US) 2008-11-13 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-20090012299-A1 Pyrazolo-pyridinone compounds and methods of use thereof MAPK1, MAP3K1, MAP4K2 MAPK14 41/4885CYP3A4 964/4885MAP2K1 117/4885

“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.