SCHEMBL2402364

SCHEMBL2402364

CC(C#N)(COc1cc(C#N)ccc1Oc1ccc(F)cc1Cl)NC(=O)c1c(SF)c(SF)c(SF)c(SF)c1SF

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 2/20 0.39
EGLN1 Q9GZT9 2/20 0.39
SLC22A12 Q96S37 3/20 0.37
SCN8A Q9UQD0 2/20 0.36
SCN10A Q9Y5Y9 2/20 0.36
TBXA2R P21731 1/20 0.35
AR P10275 1/20 0.35
SLC6A3 Q01959 2/20 0.35
SLC6A4 P31645 1/20 0.35
KCNH2 Q12809 1/20 0.35
SLC6A2 P23975 1/20 0.34
NR3C1 P04150 1/20 0.34
PGR P06401 1/20 0.34
NR3C2 P08235 1/20 0.34

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
SCHEMBL2404807 1.00 EGLN2 (0.39) EGLN2EGLN1SLC22A12SCN8ASCN10A
SCHEMBL2405330 1.00 EGLN2 (0.39) EGLN2EGLN1SLC22A12SCN8ASCN10A
SCHEMBL2403497 0.92 SLC6A4 (0.43) TBXA2RARSLC6A3SLC6A4KCNH2
SCHEMBL2405308 0.92 SLC6A4 (0.43) TBXA2RARSLC6A3SLC6A4KCNH2
SCHEMBL2400494 0.92 SLC6A4 (0.43) TBXA2RARSLC6A3SLC6A4KCNH2
SCHEMBL2402872 0.90 AR (0.36) SCN8ASCN10ATBXA2RARNR3C1
SCHEMBL2404848 0.90 AR (0.36) SCN8ASCN10ATBXA2RARNR3C1
SCHEMBL2404823 0.90 AR (0.36) SCN8ASCN10ATBXA2RARNR3C1
SCHEMBL15163377 0.89 PPARD (0.36) SCN8ASCN10ATBXA2RSLC6A3SLC6A4
SCHEMBL2402520 0.89 PPARD (0.36) SCN8ASCN10ATBXA2RSLC6A3SLC6A4

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
EP-2373162-B1 AMIDOACETONITRILE COMPOUNDS AND PESTICIDAL COMPOSITION THEREOF NOVARTIS AG (CH) 2013-08-14 EP disclosed
US-8168681-B2 Amidoacetonitrile compounds and pesticidal composition thereof NOVARTIS AG (CH) 2012-05-01 US disclosed
US-20110230563-A1 AMIDOACETONITRILE COMPOUNDS AND PESTICIDAL COMPOSITION THEREOF NOVARTIS AG 2011-09-22 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 (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-20110230563-A1 AMIDOACETONITRILE COMPOUNDS AND PESTICIDAL COMPOSITION THEREOF NAAA, PTMS, NIT2 EGLN2 966/4885EGLN1 453/4885SLC22A12 4668/4885

“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.