SCHEMBL3639337

SCHEMBL3639337

Fc1ncccc1-c1ncnc2cc[nH]c12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.44
PIK3CA P42336 1/20 0.36
EIF4E P06730 1/20 0.34
MKNK1 Q9BUB5 1/20 0.34
MKNK2 Q9HBH9 1/20 0.34
CYP11B2 P19099 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
EGFR P00533 4/20 0.33
ERBB2 P04626 4/20 0.33
ERBB3 P21860 4/20 0.33
ERBB4 Q15303 4/20 0.33
MAPT P10636 3/20 0.33
MTOR P42345 1/20 0.32
BRAF P15056 2/20 0.32
AXL P30530 1/20 0.32
NUDT1 P36639 1/20 0.32
TGFBR1 P36897 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
ALOX5AP P20292 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
SCHEMBL3639239 0.76 JAK2 (0.54) DYRK1ANUDT1
SCHEMBL9912776 0.70 MTOR (0.39) PIK3CAMAPTMTORBRAF
SCHEMBL6526218 0.69 MAPK1 (0.57) ALOX5APFEN1
SCHEMBL1833181 0.68 NUDT1 (0.38) CYP11B2MAPTAXLNUDT1MAOA
SCHEMBL3769366 0.68 TGFBR1 (0.38) DYRK1APIK3CAEGFRTGFBR1
SCHEMBL1264612 0.66 KIT (0.60) EGFR
SCHEMBL12849252 0.66 MAPT (0.46) MAPTAXLNUDT1ALOX5APFEN1
SCHEMBL3677097 0.66 L3MBTL1 (0.46) PIK3CAMKNK1MAPT
SCHEMBL22408613 0.65 CSNK1A1 (0.47) CYP11B2MAPTMTOR
SCHEMBL30912198 0.63 CDC25B (0.44) CYP11B2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140005198-A1 RAF KINASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2014-01-02 US disclosed
US-8557830-B2 RAF kinase modulators and methods of use AMGEN INC. (US) 2013-10-15 US disclosed
US-8557830-B2 RAF kinase modulators and methods of use AMGEN INC. (US) 2013-10-15 US disclosed
US-8557830-B2 RAF kinase modulators and methods of use AMGEN INC. (US) 2013-10-15 US disclosed
US-20100324047-A1 RAF KINASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2010-12-23 US disclosed
US-20100324047-A1 RAF KINASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2010-12-23 US disclosed
US-20100324047-A1 RAF KINASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2010-12-23 US disclosed
EP-2170887-A2 HETEROCYCLIC COMPOUNDS AS RAF KINASE MODULATORS Amgen Inc. (US) 2010-04-07 EP disclosed
WO-2008153947-A2 HETEROCYCLIC COMPOUNDS AS RAF KINASE MODULATORS AMGEN INC. (US) 2008-12-18 WO disclosed
WO-2008153947-A2 HETEROCYCLIC COMPOUNDS AS RAF KINASE MODULATORS AMGEN INC. (US) 2008-12-18 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-20100324047-A1 RAF KINASE MODULATORS AND METHODS OF USE BRAF, RAF1, ARAF DYRK1A 628/4885PIK3CA 59/4885EIF4E 1374/4885
US-20140005198-A1 RAF KINASE MODULATORS AND METHODS OF USE BRAF, RAF1, ARAF DYRK1A 645/4885PIK3CA 60/4885EIF4E 1602/4885

“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.