SCHEMBL17427403

SCHEMBL17427403

Cn1nnnc1NC(=O)c1nn(C)c(=O)n(-c2ccc(OC(F)(F)F)cc2)c1=O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.39
MAPT P10636 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
FLT1 P17948 1/20 0.38
KDR P35968 1/20 0.38
PFKFB3 Q16875 1/20 0.36
TP53 P04637 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GLA P06280 1/20 0.36
MAPK1 P28482 1/20 0.36
SMURF1 Q9HCE7 1/20 0.36
MET P08581 1/20 0.36
AXL P30530 1/20 0.35

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
SCHEMBL17430384 0.87 POLB (0.41) POLBMAPTFLT1KDRMET
SCHEMBL17430007 0.86 MET (0.41) POLBMETAXL
SCHEMBL17427383 0.83 POLB (0.42) POLBMAPTTP53SMN1; SMN2MET
SCHEMBL16022006 0.83 POLB (0.39) POLBL3MBTL1TP53SMN1; SMN2MET
SCHEMBL17427393 0.83 POLB (0.49) POLBMAPTL3MBTL1SMURF1
SCHEMBL17427397 0.83 POLB (0.44) POLBL3MBTL1SMN1; SMN2MET
SCHEMBL17427386 0.81 POLB (0.42) POLBMAPTMETAXL
SCHEMBL17430275 0.81 IKBKE (0.40) POLBMAPTTP53SMN1; SMN2
SCHEMBL17427455 0.81 POLB (0.41) POLBMAPTTP53METAXL
SCHEMBL18590179 0.80 MAPT (0.43) POLBMAPTFLT1KDRTP53

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-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

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 4093/4885MAPT 4184/4885L3MBTL1 1611/4885

“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.