SCHEMBL2085018

SCHEMBL2085018

CCOC(=O)c1ccc(C(F)(F)F)nc1NCCC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.41
KDM4E B2RXH2 6/20 0.40
ALDH1A1 P00352 4/20 0.40
JUN P05412 4/20 0.39
NFKB1 P19838 4/20 0.39
NFKB2 Q00653 4/20 0.39
RELA Q04206 4/20 0.39
FOS P01100 3/20 0.39
CYP1A2 P05177 3/20 0.39
CYP2C9 P11712 3/20 0.39
CYP2C19 P33261 2/20 0.39
MAPT P10636 2/20 0.39
CYP2D6 P10635 1/20 0.39
LMNA P02545 2/20 0.38
CYP3A4 P08684 2/20 0.38
HPGD P15428 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
NPSR1 Q6W5P4 3/20 0.37
JAK2 O60674 1/20 0.37

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
SCHEMBL15635108 0.89 KDM4E (0.46) SYKKDM4EALDH1A1JUNNFKB1
SCHEMBL15636201 0.86 SYK (0.45) SYKKDM4EALDH1A1JUNNFKB1
SCHEMBL2087996 0.85 ALDH1A1 (0.46) KDM4EALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL15635500 0.82 SYK (0.42) SYKKDM4EALDH1A1JUNNFKB1
SCHEMBL2086011 0.80 NPSR1 (0.44) KDM4EALDH1A1MAPTLMNANPSR1
SCHEMBL15636051 0.79 SYK (0.43) SYKKDM4EALDH1A1JUNNFKB1
SCHEMBL1373222 0.79 SYK (0.43) SYKKDM4EALDH1A1JUNNFKB1
SCHEMBL6217104 0.78 HPGD (0.46) SYKKDM4EALDH1A1JUNNFKB1
SCHEMBL13063042 0.78 TUBB4A (0.46) KDM4EALDH1A1MAPTCYP3A4HPGD
SCHEMBL3204442 0.77 GAA (0.45) SYKKDM4EALDH1A1JUNNFKB1

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 5 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
EP-1991227-A2 PROLYL HYDROXYLASE INHIBITORS SmithKline Beecham Corporation (US) 2008-11-19 EP 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

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 SYK 4534/4885KDM4E 566/4885ALDH1A1 319/4885
US-20070213335-A1 Prolyl Hydroxylase Inhibitors HIF1AN, EGLN2, EGLN3 SYK 4534/4885KDM4E 566/4885ALDH1A1 319/4885

“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.