SCHEMBL16022019

SCHEMBL16022019

Cn1nnnc1NC(=O)c1nn(C)c(=O)n(-c2ccc(F)cn2)c1=O

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.41
GRM5 P41594 12/20 0.41
MET P08581 1/20 0.35
GRM4 Q14833 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
AHR P35869 1/20 0.34
LMNA P02545 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33

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
SCHEMBL17427470 0.88 POLB (0.46) POLBGRM5SMN1; SMN2LMNACNR1
SCHEMBL16022000 0.86 MET (0.44) POLBGRM5METSMN1; SMN2LMNA
SCHEMBL17427408 0.81 POLB (0.41) POLBGRM5METSMN1; SMN2LMNA
SCHEMBL17427462 0.81 POLB (0.40) POLBGRM5METLMNACNR1
SCHEMBL17427356 0.81 POLB (0.48) POLBMETLMNA
SCHEMBL16022128 0.81 POLB (0.47) POLBGRM5GRM4SMN1; SMN2LMNA
SCHEMBL17427392 0.80 POLB (0.43) POLBGRM5METSMN1; SMN2LMNA
SCHEMBL16022020 0.80 POLB (0.41) POLBGRM5METSMN1; SMN2LMNA
SCHEMBL17222514 0.79 POLB (0.51) POLBSMN1; SMN2LMNA
SCHEMBL16022005 0.79 POLB (0.44) POLBMETLMNA

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
US-20160009693-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2016-01-14 US disclosed
US-20160009693-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2016-01-14 US disclosed
WO-2014135654-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2014-09-12 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-20160009693-A1 HERBICIDAL COMPOUNDS DDT, HAX1, CYP4X1 POLB 4093/4885GRM5 1577/4885MET 3504/4885

“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.