SCHEMBL2086548

SCHEMBL2086548

CC(C)CCn1c(=O)c(C(=O)NCC(=O)O)c(O)c2cccnc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR3E A5X5Y0 1/20 0.51
HTR3B O95264 1/20 0.51
HTR3A P46098 1/20 0.51
HTR3D Q70Z44 1/20 0.51
HTR3C Q8WXA8 1/20 0.51
CNR2 P34972 7/20 0.50
CNR1 P21554 5/20 0.50
EGLN1 Q9GZT9 2/20 0.50
ALDH1A1 P00352 3/20 0.48
LMNA P02545 3/20 0.48
HTT P42858 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TSHR P16473 2/20 0.48
USP2 O75604 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
MAPT P10636 3/20 0.47
RXFP1 Q9HBX9 3/20 0.47
KDM4E B2RXH2 2/20 0.47
TP53 P04637 1/20 0.47
MEN1 O00255 1/20 0.47

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
SCHEMBL2088540 0.86 EGLN1 (0.53) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL2085891 0.86 CNR2 (0.50) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL2576889 0.84 EGLN1 (0.59) EGLN1ALDH1A1LMNANPSR1KDM4E
SCHEMBL8244097 0.83 EGLN1 (0.69) EGLN1ALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL2085626 0.83 HIF1A (0.59) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL2087702 0.82 EGLN1 (0.71) CNR2CNR1EGLN1ALDH1A1LMNA
SCHEMBL3512688 0.81 EGLN1 (0.52) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL3514578 0.81 EGLN1 (0.60) CNR2CNR1EGLN1RXFP1TP53
SCHEMBL3514655 0.80 MEN1 (0.55) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL3512025 0.80 EGLN1 (0.61) CNR2CNR1EGLN1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7897612-B2 Substituted 1,8-naphthyridinecarboxamides for use as prolyl hydroxylase inhibitors GlaxoSmithKline, LLC (US) 2011-03-01 US claimed
US-20090082357-A1 Prolyl Hydroxylase Inhibitors GLAXOSMITHKLINE LLC 2009-03-26 US claimed
EP-1991227-A2 PROLYL HYDROXYLASE INHIBITORS SmithKline Beecham Corporation (US) 2008-11-19 EP claimed
WO-2007103905-A2 PROLYL HYDROXYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2007-09-13 WO claimed
US-20070213335-A1 Prolyl Hydroxylase Inhibitors SMITHKLINE BEECHAM CORPORATION 2007-09-13 US claimed
US-7897612-B2 Substituted 1,8-naphthyridinecarboxamides for use as prolyl hydroxylase inhibitors GlaxoSmithKline, LLC (US) 2011-03-01 US disclosed
US-7897612-B2 Substituted 1,8-naphthyridinecarboxamides for use as prolyl hydroxylase inhibitors GlaxoSmithKline, LLC (US) 2011-03-01 US disclosed
US-7897612-B2 Substituted 1,8-naphthyridinecarboxamides for use as prolyl hydroxylase inhibitors GlaxoSmithKline, LLC (US) 2011-03-01 US disclosed
US-20090082357-A1 Prolyl Hydroxylase Inhibitors GLAXOSMITHKLINE LLC 2009-03-26 US disclosed
US-20090082357-A1 Prolyl Hydroxylase Inhibitors GLAXOSMITHKLINE LLC 2009-03-26 US disclosed
US-20090082357-A1 Prolyl Hydroxylase Inhibitors GLAXOSMITHKLINE LLC 2009-03-26 US disclosed
WO-2007103905-A2 PROLYL HYDROXYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2007-09-13 WO disclosed
US-20070213335-A1 Prolyl Hydroxylase Inhibitors SMITHKLINE BEECHAM CORPORATION 2007-09-13 US disclosed
US-20070213335-A1 Prolyl Hydroxylase Inhibitors SMITHKLINE BEECHAM CORPORATION 2007-09-13 US disclosed
US-20070213335-A1 Prolyl Hydroxylase Inhibitors SMITHKLINE BEECHAM CORPORATION 2007-09-13 US 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-20090082357-A1 Prolyl Hydroxylase Inhibitors HIF1AN, EGLN2, EGLN3 HTR3E 3336/4885HTR3B 2458/4885HTR3A 2335/4885
US-20070213335-A1 Prolyl Hydroxylase Inhibitors HIF1AN, EGLN2, EGLN3 HTR3E 3336/4885HTR3B 2458/4885HTR3A 2335/4885

“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.