SCHEMBL16166142

SCHEMBL16166142

CC(=O)CC(=O)N(C)c1cccnc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.56
POLQ O75417 1/20 0.53
TRPV1 Q8NER1 1/20 0.48
PYGL P06737 1/20 0.46
GAA P10253 2/20 0.45
HPGD P15428 1/20 0.45
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
GFER P55789 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PKM P14618 1/20 0.39
KMT2A Q03164 1/20 0.39
PLOD2 O00469 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2A6 P11509 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
CHRNB2 P17787 1/20 0.39

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
SCHEMBL25629360 0.83 NOTUM (0.58) NOTUMPOLQTRPV1PYGLGAA
SCHEMBL6164413 0.83 NOTUM (0.58) NOTUMPOLQTRPV1PYGLGAA
SCHEMBL25733507 0.81 NOTUM (0.56) NOTUMPOLQTRPV1PYGLGAA
SCHEMBL3576501 0.81 NOTUM (0.51) NOTUMPOLQTRPV1PYGLGAA
SCHEMBL2435091 0.81 NOTUM (0.56) NOTUMPOLQTRPV1PYGLHPGD
SCHEMBL27657777 0.80 NOTUM (0.59) NOTUMPOLQTRPV1PYGLGAA
SCHEMBL13824325 0.80 POLQ (0.49) POLQHTTALDH1A1MAPTGFER
Hydrochloric Acid SCHEMBL5349528 0.80 NOTUM (0.50) NOTUMPOLQTRPV1PYGLGAA
SCHEMBL16353843 0.79 NOTUM (0.54) NOTUMPOLQTRPV1PYGLHTT
SCHEMBL6659655 0.79 KMT2A (0.53) POLQHTTALDH1A1NPSR1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9751862-B2 Pesticidally active substituted pyridyl carboxamides SYNGENTA PARTICIPATIONS AG (CH) 2017-09-05 US disclosed
US-9750253-B2 Pesticidally active substituted pyridyl carboxamides SYNGENTA PARTICIPATIONS AG (CH) 2017-09-05 US disclosed
US-20170107200-A1 PESTICIDALLY ACTIVE SUBSTITUTED PYRIDYL CARBOXAMIDES SYNGENTA PARTICIPATIONS AG (CH) 2017-04-20 US disclosed
EP-2984083-B1 PESTICIDALLY ACTIVE SUBSTITUTED PYRIDYL CARBOXAMIDES SYNGENTA PARTICIPATIONS AG (CH) 2017-01-25 EP disclosed
EP-3119758-A1 PESTICIDALLY ACTIVE SUBSTITUTED PYRIDYL CARBOXAMIDES Syngenta Participations AG (CH) 2017-01-25 EP disclosed
US-20160050924-A1 PESTICIDALLY ACTIVE SUBSTITUTED PYRIDYL CARBOXAMIDES SYNGENTA PARTICIPATIONS AG (CH) 2016-02-25 US disclosed
EP-2984083-A1 PESTICIDALLY ACTIVE SUBSTITUTED PYRIDYL CARBOXAMIDES Syngenta Participations AG (CH) 2016-02-17 EP disclosed
WO-2015140222-A1 PESTICIDALLY ACTIVE SUBSTITUTED PYRIDYL CARBOXAMIDES SYNGENTA PARTICIPATIONS AG (CH) 2015-09-24 WO disclosed
WO-2014166795-A1 PESTICIDALLY ACTIVE SUBSTITUTED PYRIDYL CARBOXAMIDES SYNGENTA PARTICIPATIONS AG (CH) 2014-10-16 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 (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-20160050924-A1 PESTICIDALLY ACTIVE SUBSTITUTED PYRIDYL CARBOXAMIDES CBR3, CBR1, CYCS NOTUM 635/4885POLQ 2529/4885TRPV1 1532/4885
US-20170107200-A1 PESTICIDALLY ACTIVE SUBSTITUTED PYRIDYL CARBOXAMIDES CBR3, CBR1, CYCS NOTUM 392/4885POLQ 3696/4885TRPV1 2459/4885

“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.