SCHEMBL6730706

SCHEMBL6730706

N#Cc1ccc2n[nH]c(=O)n2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 1/20 0.44
CHEK1 O14757 1/20 0.42
PRMT5 O14744 1/20 0.41
WDR77 Q9BQA1 1/20 0.41
NOTUM Q6P988 3/20 0.38
PDE5A O76074 1/20 0.36
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
JAK3 P52333 1/20 0.35
AHR P35869 2/20 0.35
FLT3 P36888 1/20 0.33
TYMP P19971 1/20 0.33
IRAK1 P51617 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
EGLN2 Q96KS0 1/20 0.33
APP P05067 1/20 0.33
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
HTR1A P08908 1/20 0.32
DRD2 P14416 1/20 0.32

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
SCHEMBL5254089 0.73 SCN5A (0.48) SCN5ACHEK1NOTUMPDE5APDE3B
SCHEMBL2462263 0.73 SCN5A (0.48) SCN5APRMT5WDR77NOTUMALDH1A1
SCHEMBL3435779 0.73 SCN5A (0.48) SCN5ACHEK1PRMT5WDR77NOTUM
SCHEMBL20772490 0.73 SCN5A (0.51) SCN5APRMT5WDR77NOTUMPDE5A
SCHEMBL20772890 0.70 CHEK1 (0.40) SCN5ACHEK1NOTUMPDE3AALDH1A1
SCHEMBL20773134 0.69 SCN5A (0.48) SCN5ANOTUMPDE5A
SCHEMBL18655673 0.69 SCN5A (0.44) SCN5ANOTUMPDE5A
SCHEMBL3708402 0.69 SCN5A (0.44) SCN5ACHEK1NOTUMPDE5APDE3B
SCHEMBL18632535 0.69 SCN5A (0.62) SCN5ACHEK1PRMT5WDR77NOTUM
SCHEMBL6724420 0.69 SCN5A (0.55) SCN5ANOTUMALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040063580-A1 Bicyclic triazolone derivatives and a herbicides containing the same SUMITOMO CHEMICAL TAKEDA AGRO COMPANY, LIMITED (JP) 2004-04-01 US disclosed
EP-1333031-A1 BICYCLIC TRIAZOLONE DERIVATIVES AND HERBICIDES CONTAINING THE SAME Sumitomo Chemical Takeda Agro Company, Limited (JP) 2003-08-06 EP 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-20040063580-A1 Bicyclic triazolone derivatives and a herbicides containing the same WEE1, WEE2, BAK1 SCN5A 2799/4885CHEK1 730/4885PRMT5 3132/4885

“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.