SCHEMBL2087007

SCHEMBL2087007

CCOC(=O)c1cccnc1NCCN(C)C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.57
POLB P06746 2/20 0.52
RAD52 P43351 2/20 0.52
KDM4E B2RXH2 2/20 0.51
ALDH1A1 P00352 2/20 0.51
HPGD P15428 1/20 0.51
HSD17B10 Q99714 1/20 0.51
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
GAA P10253 1/20 0.50
TSHR P16473 1/20 0.46
PPIA P62937 1/20 0.46
UHRF1 Q96T88 1/20 0.45
KAT2B Q92831 1/20 0.44
CYP2C19 P33261 2/20 0.44
MAPT P10636 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
MAPK1 P28482 1/20 0.44

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
SCHEMBL6587986 0.89 HTT (0.56) HTTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL6612663 0.87 ALDH1A1 (0.68) HTTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL6605329 0.84 HTT (0.60) HTTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL28137220 0.84 HTT (0.65) HTTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL8567716 0.83 HTT (0.62) HTTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL4611494 0.82 HTT (0.64) HTTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL2087895 0.82 HTT (0.57) HTTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL1523101 0.82 HTT (0.57) HTTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL1522683 0.81 MAPT (0.62) HTTPOLBKDM4EALDH1A1HPGD
SCHEMBL5763552 0.80 HTT (0.61) HTTKDM4EALDH1A1HPGDHSD17B10

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 3 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 disclosed
US-20090082357-A1 Prolyl Hydroxylase Inhibitors GLAXOSMITHKLINE LLC 2009-03-26 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 HTT 1880/4885POLB 1049/4885RAD52 2576/4885
US-20070213335-A1 Prolyl Hydroxylase Inhibitors HIF1AN, EGLN2, EGLN3 HTT 1880/4885POLB 1049/4885RAD52 2576/4885

“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.