SCHEMBL4947244

SCHEMBL4947244

CN(c1ccc(F)c(Cl)c1)c1ncnc(Cl)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
MAPK1 P28482 1/20 0.36
DOT1L Q8TEK3 1/20 0.34
KMO O15229 1/20 0.33
APP P05067 1/20 0.33
EGFR P00533 6/20 0.33
TSHR P16473 1/20 0.32
KDR P35968 2/20 0.32
DYRK1A Q13627 1/20 0.32
AURKA O14965 1/20 0.32
ERBB2 P04626 1/20 0.32
INSR P06213 1/20 0.32
FBP1 P09467 1/20 0.32
PDGFRB P09619 1/20 0.32
FLT4 P35916 1/20 0.32
CLK1 P49759 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
SCHEMBL6487453 0.82 ALDH1A1 (0.34) ALDH1A1MAPK1KMOAPPEGFR
SCHEMBL4947246 0.79 EGFR (0.47) ALDH1A1DOT1LEGFRKDRDYRK1A
SCHEMBL6479935 0.79 ALDH1A1 (0.32) ALDH1A1MAPK1EGFRERBB2
SCHEMBL14214685 0.72 MAPK1 (0.55) ALDH1A1MAPK1APPEGFRKDR
SCHEMBL10639151 0.71 ALDH1A1 (0.47) ALDH1A1MAPK1KMOAPPTSHR
SCHEMBL10151137 0.70 KDR (0.49) HDAC3HDAC1HDAC2HDAC6KDR
SCHEMBL1042543 0.69 ALDH1A1 (0.47) ALDH1A1APPTSHR
SCHEMBL27876061 0.69 CSF1R (0.49) EGFRKDRPDGFRBCSF1R
SCHEMBL715925 0.67 HSD17B10 (0.39) ALDH1A1DYRK1ACLK1
SCHEMBL14107188 0.67 ALDH1A1 (0.45) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1218360-B1 TRIAZINE KINASE INHIBITORS AMGEN INC (US) 2008-05-28 EP disclosed
US-7074789-B2 Kinase inhibitors AMGEN INC. (US) 2006-07-11 US disclosed
US-6881737-B2 Substituted triazinyl acrylamide derivatives and methods of use AMGEN INC. (US) 2005-04-19 US disclosed
US-6864255-B2 Substituted triazinyl amide derivatives and methods of use AMGEN INC. (US) 2005-03-08 US disclosed
US-20040116388-A1 triazine compoound inhibitors of enzymes that catalyze phosphoryl transfer and/or that bind ATP/GTP nucleotides AMGEN INC. 2004-06-17 US disclosed
EP-1390354-A1 TRIAZINYL ACRYLAMIDE DERIVATIVES AS KINASE INHIBITORS Amgen Inc. (US) 2004-02-25 EP disclosed
US-20030139416-A1 Substituted triazinyl acrylamide derivatives and methods of use AMGEN INC. 2003-07-24 US disclosed
US-20030087908-A1 Substituted triazinyl amide derivatives and methods of use AMGEN INC. 2003-05-08 US disclosed
WO-2002083653-A1 TRIAZINYL ACRYLAMIDE DERIVATIVES AS KINASE INHIBITORS AMGEN INC. (US) 2002-10-24 WO disclosed
EP-1218360-A1 TRIAZINE KINASE INHIBITORS Amgen Inc., (US) 2002-07-03 EP disclosed
WO-2001025220-A1 TRIAZINE KINASE INHIBITORS AMGEN INC. (US) 2001-04-12 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-20030139416-A1 Substituted triazinyl acrylamide derivatives and methods of use PKD1, PKD2, GLS ALDH1A1 1130/4885HDAC3 584/4885HDAC1 2454/4885
US-20030087908-A1 Substituted triazinyl amide derivatives and methods of use FLT4, FLT1, VEGFA ALDH1A1 868/4885HDAC3 10/4885HDAC1 127/4885

“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.