SCHEMBL1667038

SCHEMBL1667038

[CH2]c1cc(Nc2nccc(-c3ccc(OC)c(C#N)c3)n2)cc(OC)c1OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.58
CDK2 P24941 3/20 0.58
JAK2 O60674 1/20 0.58
PIK3CA P42336 1/20 0.58
PIK3CB P42338 1/20 0.58
PIK3CG P48736 1/20 0.58
PTK2B Q14289 1/20 0.58
ZAP70 P43403 10/20 0.54
PRKD3 O94806 3/20 0.54
PRKCG P05129 3/20 0.54
PRKCB P05771 3/20 0.54
LCK P06239 3/20 0.54
PRKCA P17252 3/20 0.54
PRKCH P24723 3/20 0.54
PRKCI P41743 3/20 0.54
PRKCE Q02156 3/20 0.54
PRKCQ Q04759 3/20 0.54
PRKCZ Q05513 3/20 0.54
PRKCD Q05655 3/20 0.54
PRKD1 Q15139 3/20 0.54

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
SCHEMBL1667266 0.93 EGFR (0.67) EGFRCDK2JAK2PIK3CAPIK3CB
SCHEMBL1667125 0.85 EGFR (0.55) EGFRCDK2JAK2PIK3CAPIK3CB
SCHEMBL12276011 0.85 MEN1 (0.56) EGFRCDK2JAK2PIK3CAPIK3CB
SCHEMBL1670000 0.85 EGFR (0.60) EGFRCDK2JAK2PIK3CAPIK3CB
SCHEMBL12274953 0.84 EGFR (0.53) EGFRCDK2JAK2PIK3CAPIK3CB
SCHEMBL1667135 0.84 CDK2 (0.66) EGFRCDK2JAK2PIK3CAPIK3CB
SCHEMBL12274689 0.83 MEN1 (0.56) EGFRCDK2JAK2PIK3CAPIK3CB
SCHEMBL12274038 0.82 MEN1 (0.53) EGFRCDK2JAK2PIK3CAPIK3CB
SCHEMBL1667153 0.81 MEN1 (0.56) EGFRCDK2JAK2PIK3CAPIK3CB
SCHEMBL13279540 0.81 MEN1 (0.51) EGFRCDK2JAK2PIK3CAPIK3CB

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
EP-2488503-A1 AMINO - PYRIMIDINE COMPOUNDS AS INHIBITORS OF TBKL AND/OR IKK EPSILON Myrexis, Inc. (US) 2012-08-22 EP claimed
WO-2011046970-A1 AMINO - PYRIMIDINE COMPOUNDS AS INHIBITORS OF TBKL AND/OR IKK EPSILON MYREXIS, INC. (US) 2011-04-21 WO claimed
EP-2488503-A1 AMINO - PYRIMIDINE COMPOUNDS AS INHIBITORS OF TBKL AND/OR IKK EPSILON Myrexis, Inc. (US) 2012-08-22 EP disclosed
WO-2011046970-A1 AMINO - PYRIMIDINE COMPOUNDS AS INHIBITORS OF TBKL AND/OR IKK EPSILON MYREXIS, INC. (US) 2011-04-21 WO disclosed