SCHEMBL2698529

SCHEMBL2698529

CC(C)(C)OC(=O)Cc1ccc2nc[nH]c(=O)c2c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.54
IP6K1 Q92551 6/20 0.52
IP6K3 Q96PC2 2/20 0.52
IP6K2 Q9UHH9 2/20 0.52
PARP1 P09874 7/20 0.49
DHFR P00374 4/20 0.47
CHEK1 O14757 1/20 0.46
PIM1 P11309 1/20 0.46
AKT1 P31749 1/20 0.46
FLT3 P36888 1/20 0.46
PIM3 Q86V86 1/20 0.46
ACVR1 Q04771 1/20 0.42
FPGS Q05932 1/20 0.41

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
SCHEMBL496967 0.80 IP6K1 (0.65) SLC2A1IP6K1IP6K3IP6K2PARP1
SCHEMBL2699051 0.77 KDM4E (0.50) IP6K1ACVR1
SCHEMBL2699340 0.76 MAP4K4 (0.55)
SCHEMBL22980875 0.75 IP6K1 (0.66) SLC2A1IP6K1IP6K3IP6K2PARP1
SCHEMBL2700897 0.74 ECE2 (0.50)
SCHEMBL7427860 0.73 IP6K1 (0.68) SLC2A1IP6K1IP6K3IP6K2PARP1
SCHEMBL8170598 0.73 IP6K1 (0.71) SLC2A1IP6K1IP6K3IP6K2PARP1
SCHEMBL2698516 0.72 EGFR (0.39) PARP1
SCHEMBL22042406 0.72 IP6K1 (0.61) SLC2A1IP6K1IP6K3IP6K2PARP1
SCHEMBL20334906 0.72 IP6K1 (0.61) SLC2A1IP6K1IP6K3IP6K2PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3093289-A1 [1,2,4]TRIAZOLO[4,3-A]PYRIDINE DERIVATIVES USEFUL AS INHIBITORS OF THE HEPATOCYTE GROWTH FACTOR RECEPTOR Amgen, Inc (US) 2016-11-16 EP disclosed
EP-2081931-B1 [1,2,4]Triazolo[4,3-a]pyridine derivatives useful as inhibitors of the hepatocyte growth factor receptor AMGEN INC (US) 2016-08-31 EP disclosed
US-9066954-B2 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2015-06-30 US disclosed
US-20130303529-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE AMGEN INC (US) 2013-11-14 US disclosed
US-8524900-B2 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2013-09-03 US disclosed
EP-2578583-A1 Fused heterocyclic derivatives and methods of use Amgen Inc. (US) 2013-04-10 EP disclosed
CN-101528743-B Fused heterocyclic derivatives and methods of use AMGEN INC 2013-02-06 CN disclosed
US-8217177-B2 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2012-07-10 US disclosed
US-8212041-B2 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2012-07-03 US disclosed
US-20120148531-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2012-06-14 US disclosed
US-8198448-B2 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2012-06-12 US disclosed
US-20120107275-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2012-05-03 US disclosed
US-20090318436-A1 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2009-12-24 US disclosed
CN-101528743-A Fused heterocyclic derivatives and methods of use AMGEN INC (US) 2009-09-09 CN disclosed
EP-2081931-A2 FUSED HETEROCYCLIC DERIVATIVES USEFUL AS INHIBITORS OF THE HEPATOCYTE GROWTH FACTOR RECEPTOR Amgen Inc. (US) 2009-07-29 EP disclosed
US-20090124612-A1 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2009-05-14 US disclosed
US-20090124609-A1 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2009-05-14 US disclosed
WO-2008008539-A2 FUSED HETEROCYCLIC DERIVATIVES USEFUL AS INHIBITORS OF THE HEPATOCYTE GROWTH FACTOR RECEPTOR AMGEN INC. (US) 2008-01-17 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 (6 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-20090318436-A1 Fused heterocyclic derivatives and methods of use HGF, HGFAC, MET SLC2A1 1405/4885IP6K1 3165/4885IP6K3 3105/4885
US-20120148531-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE HGF, HGFAC, MET SLC2A1 1405/4885IP6K1 3165/4885IP6K3 3105/4885
US-20090124612-A1 Fused heterocyclic derivatives and methods of use HGF, HGFAC, MET SLC2A1 1405/4885IP6K1 3165/4885IP6K3 3105/4885
US-20130303529-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE HGF, HGFAC, MET SLC2A1 1405/4885IP6K1 3165/4885IP6K3 3105/4885
US-20090124609-A1 Fused heterocyclic derivatives and methods of use HGF, HGFAC, MET SLC2A1 1405/4885IP6K1 3165/4885IP6K3 3105/4885
US-20120107275-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE HGF, HGFAC, MET SLC2A1 1405/4885IP6K1 3165/4885IP6K3 3105/4885

“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.