SCHEMBL2086285

SCHEMBL2086285

CCOC(=O)c1cccnc1NCc1ccccc1Cl

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.57
SLC26A6 Q9BXS9 1/20 0.54
CASP3 P42574 2/20 0.54
SENP8 Q96LD8 2/20 0.54
SENP7 Q9BQF6 2/20 0.54
SENP6 Q9GZR1 2/20 0.54
RXFP1 Q9HBX9 1/20 0.53
MAPT P10636 3/20 0.53
LMNA P02545 1/20 0.53
TP53 P04637 1/20 0.53
ALDH1A1 P00352 2/20 0.52
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
MAPK8 P45983 3/20 0.47
AURKA O14965 1/20 0.47
RPS6KB1 P23443 1/20 0.47
TSHR P16473 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
PPIA P62937 1/20 0.46

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
SCHEMBL2087990 0.83 HTT (0.65) HTTSLC26A6MAPTLMNATP53
SCHEMBL4457757 0.81 AURKA (0.63) HTTCASP3SENP8SENP7SENP6
SCHEMBL28137220 0.81 HTT (0.65) HTTMAPTTP53ALDH1A1MEN1
SCHEMBL4611494 0.79 HTT (0.64) HTTMAPTTP53ALDH1A1TSHR
SCHEMBL28236466 0.79 KDR (0.62) HTTMAPT
SCHEMBL6612663 0.78 ALDH1A1 (0.68) HTTMAPTLMNATP53ALDH1A1
SCHEMBL5763552 0.77 HTT (0.61) HTTMAPTTP53ALDH1A1TSHR
SCHEMBL4174847 0.77 MAPT (0.56) HTTSLC26A6MAPTLMNAALDH1A1
SCHEMBL28000002 0.76 HTT (0.67) HTTMAPTTP53ALDH1A1TSHR
SCHEMBL9715609 0.76 HTT (0.54) HTTMAPTLMNAALDH1A1MEN1

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 1880/4885SLC26A6 1303/4885CASP3 4226/4885
US-20070213335-A1 Prolyl Hydroxylase Inhibitors HIF1AN, EGLN2, EGLN3 HTT 1880/4885SLC26A6 1303/4885CASP3 4226/4885

“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.