SCHEMBL5160782

SCHEMBL5160782

CC#CC(C)(C)NC(=O)C(CC)Oc1cc(Cl)nc(Cl)c1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
ALDH1A1 P00352 3/20 0.34
HSD17B10 Q99714 2/20 0.34
ADORA3 P0DMS8 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
TSHR P16473 2/20 0.33
LMNA P02545 2/20 0.33
HTT P42858 1/20 0.33
MAPT P10636 3/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
TP53 P04637 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
ANO1 Q5XXA6 1/20 0.31

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
SCHEMBL5158190 0.89 NPSR1 (0.33) PKMNPSR1ALDH1A1HSD17B10ADORA3
SCHEMBL4616219 0.88 PKM (0.35) PKMNPSR1ALDH1A1HSD17B10TSHR
SCHEMBL11528939 0.85 NPSR1 (0.38) PKMNPSR1ALDH1A1HSD17B10TSHR
SCHEMBL5160452 0.83 PKM (0.35) PKM
SCHEMBL4616407 0.82 L3MBTL1 (0.34) PKMNPSR1ALDH1A1HSD17B10ADORA3
SCHEMBL5158275 0.82 ALDH1A1 (0.35) PKMNPSR1ALDH1A1HSD17B10TSHR
SCHEMBL11602647 0.82 OGG1 (0.45) NPSR1ALDH1A1TSHRMAPTMEN1
SCHEMBL1360483 0.81
SCHEMBL5344974 0.80 PKM (0.35) PKMNPSR1ALDH1A1HSD17B10ADORA3
SCHEMBL4954058 0.80 HSD17B10 (0.37) NPSR1ALDH1A1HSD17B10LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070135468-A1 PYRIDYLOXYALKANOIC ACID AMIDE DERIVATIVES USEFUL AS FUNGICIDES SYNGENTA LIMITED (GB) 2007-06-14 US disclosed
EP-1456174-B1 PYRIDYLOXYALKANOIC ACID AMIDE DERIVATIVES USEFUL AS FUNGICIDES SYNGENTA LTD (GB) 2007-02-14 EP disclosed
EP-1456174-A1 PYRIDYLOXYALKANOIC ACID AMIDE DERIVATIVES USEFUL AS FUNGICIDES Syngenta Limited (GB) 2004-09-15 EP disclosed
WO-2003048128-A1 PYRIDYLOXYALKANOIC ACID AMIDE DERIVATIVES USEFUL AS FUNGICIDES SYNGENTA LIMITED (GB) 2003-06-12 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 (1 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-20070135468-A1 PYRIDYLOXYALKANOIC ACID AMIDE DERIVATIVES USEFUL AS FUNGICIDES DDT, C3AR1, CBR3 PKM 3774/4885NPSR1 1617/4885ALDH1A1 1581/4885

“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.