SCHEMBL4949545

SCHEMBL4949545

c1ccc(Nc2ncncn2)nc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
MAPK10 P53779 1/20 0.57
GFER P55789 1/20 0.57
ADRA2A P08913 2/20 0.44
ADRA2B P18089 2/20 0.44
ADRA2C P18825 2/20 0.44
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
PKM P14618 1/20 0.44
KDR P35968 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
NFKB1 P19838 1/20 0.42
MAPK1 P28482 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
CXCR4 P61073 1/20 0.42

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
SCHEMBL3951276 0.87 MEN1 (0.67) MEN1KMT2AMAPK10GFERADRA2A
SCHEMBL29544002 0.87 MEN1 (0.67) MEN1KMT2AMAPK10GFERADRA2A
SCHEMBL1883319 0.83 KMT2A (0.57) MEN1KMT2AMAPK10GFERADRA2A
SCHEMBL221242 0.79 KMT2A (0.76) MEN1KMT2AMAPK10GFERADRA2A
SCHEMBL29391624 0.79 KMT2A (0.76) MEN1KMT2AMAPK10GFERADRA2A
SCHEMBL3948701 0.79 KMT2A (0.57) MEN1KMT2AMAPK10GFERADRA2A
SCHEMBL31355480 0.79 KMT2A (0.57) MEN1KMT2AMAPK10GFERADRA2A
SCHEMBL31355479 0.79 KMT2A (0.57) MEN1KMT2AMAPK10GFERADRA2A
SCHEMBL4243882 0.77 KMT2A (0.73) MEN1KMT2AMAPK10GFERADRA2A
SCHEMBL11133606 0.77 KMT2A (0.73) MEN1KMT2AMAPK10GFERADRA2A

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 7 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-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
US-20030087908-A1 Substituted triazinyl amide derivatives and methods of use AMGEN INC. 2003-05-08 US 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 (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-20030087908-A1 Substituted triazinyl amide derivatives and methods of use FLT4, FLT1, VEGFA MEN1 3232/4885KMT2A 2665/4885MAPK10 4141/4885

“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.