SCHEMBL1883322

SCHEMBL1883322

Cn1c(=O)c(Br)nc2cnn(-c3ccc(F)cc3F)c21

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 0.44
LCK P06239 1/20 0.44
KIT P10721 1/20 0.44
KDR P35968 1/20 0.44
MAPKAPK2 P49137 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
GLA P06280 1/20 0.39
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
CYP3A4 P08684 1/20 0.37
GAA P10253 1/20 0.36
OPRM1 P35372 1/20 0.35
CYP17A1 P05093 1/20 0.35
CYP1A2 P05177 1/20 0.35

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
SCHEMBL1878359 0.79 MAPK14 (0.47) MAPK14MAPKAPK2
SCHEMBL1877849 0.73 MAPK14 (0.47) MAPK14LCKKITKDRMAPKAPK2
SCHEMBL10624240 0.71 L3MBTL1 (0.54) MAPK14LCKKITKDRMAPKAPK2
SCHEMBL1882817 0.70 MAPK14 (0.57) MAPK14LCKKITKDRMAPKAPK2
SCHEMBL1879539 0.69 MAPK14 (0.65) MAPK14LCKKITKDRMAPKAPK2
SCHEMBL25344930 0.69 MAPK14 (0.57) MAPK14LCKKITKDRMAPKAPK2
SCHEMBL25343704 0.69 MAPK14 (0.56) MAPK14LCKKITKDRMAPKAPK2
SCHEMBL3671793 0.69 MAPK14 (0.42) MAPK14LCKKITKDRMAPKAPK2
SCHEMBL3673264 0.67 MAPK14 (0.42) MAPK14LCKKITKDRMAPKAPK2
SCHEMBL3673356 0.67 MAPK14 (0.59) MAPK14LCKKITKDRMAPKAPK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8435987-B2 Pyrazolo-pyridinone and pyrazolo-pyrazinone compounds as P38 modulators and methods of use thereof AMGEN INC. (US) 2013-05-07 US disclosed
US-8435987-B2 Pyrazolo-pyridinone and pyrazolo-pyrazinone compounds as P38 modulators and methods of use thereof AMGEN INC. (US) 2013-05-07 US disclosed
US-20110294805-A1 PYRAZOLO-PYRIDINONE AND PYRAZOLO-PYRAZINONE COMPOUNDS AS P38 MODULATORS AND METHODS OF USE THEREOF AMGEN INC. (US) 2011-12-01 US disclosed
US-20110294805-A1 PYRAZOLO-PYRIDINONE AND PYRAZOLO-PYRAZINONE COMPOUNDS AS P38 MODULATORS AND METHODS OF USE THEREOF AMGEN INC. (US) 2011-12-01 US disclosed
US-20110294805-A1 PYRAZOLO-PYRIDINONE AND PYRAZOLO-PYRAZINONE COMPOUNDS AS P38 MODULATORS AND METHODS OF USE THEREOF AMGEN INC. (US) 2011-12-01 US disclosed
US-8022085-B2 Pyrazolo-pyridinone and pyrazolo-pyrazinone compounds as P38 modulators and methods of use thereof AMGEN INC. (US) 2011-09-20 US disclosed
US-8022085-B2 Pyrazolo-pyridinone and pyrazolo-pyrazinone compounds as P38 modulators and methods of use thereof AMGEN INC. (US) 2011-09-20 US disclosed
US-8022085-B2 Pyrazolo-pyridinone and pyrazolo-pyrazinone compounds as P38 modulators and methods of use thereof AMGEN INC. (US) 2011-09-20 US disclosed
US-20110105498-A1 Pyrazolo-pyridinone and pyrazolo-pyrazinone compounds as P38 modulators and methods of use thereof AMGEN INC. (US) 2011-05-05 US disclosed
US-20110105498-A1 Pyrazolo-pyridinone and pyrazolo-pyrazinone compounds as P38 modulators and methods of use thereof AMGEN INC. (US) 2011-05-05 US disclosed
US-20110105498-A1 Pyrazolo-pyridinone and pyrazolo-pyrazinone compounds as P38 modulators and methods of use thereof AMGEN INC. (US) 2011-05-05 US disclosed
EP-2152706-A1 PYRAZOLO-PYRIDINONE AND PYRAZOLO-PYRAZINONE COMPOUNDS AS P38 MODULATORS, PROCESS FOR THEIR PREPARATION, AND THEIR PHARMACEUTICAL USE Amgen Inc. (US) 2010-02-17 EP disclosed
WO-2008136948-A1 PYRAZOLO-PYRIDINONE AND PYRAZOLO-PYRAZINONE COMPOUNDS AS P38 MODULATORS, 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 (2 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-20110294805-A1 PYRAZOLO-PYRIDINONE AND PYRAZOLO-PYRAZINONE COMPOUNDS AS P38 MODULATORS AND METHODS OF USE THEREOF MAPK1, MAP4K2, MAP3K1 MAPK14 32/4885LCK 309/4885KIT 1443/4885
US-20110105498-A1 Pyrazolo-pyridinone and pyrazolo-pyrazinone compounds as P38 modulators and methods of use thereof MAPK1, MAP4K2, MAP3K1 MAPK14 32/4885LCK 309/4885KIT 1443/4885

“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.