SCHEMBL16022141

SCHEMBL16022141

Cn1nnnc1NC(=O)c1nn(C)c(=O)n(-c2cc(Cl)cc(Cl)c2)c1=O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
ALDH1A1 P00352 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
MMEL1 Q495T6 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
HPGD P15428 1/20 0.34
CYP2C19 P33261 1/20 0.34
LMNA P02545 4/20 0.34
CTDSP1 Q9GZU7 1/20 0.33
GRM5 P41594 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GAA P10253 1/20 0.33
MET P08581 1/20 0.32
SMURF1 Q9HCE7 1/20 0.32
RIPK1 Q13546 1/20 0.32
MAPT P10636 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
SCHEMBL17427391 0.90 POLB (0.50) POLBALDH1A1SMN1; SMN2MMEL1MEN1
SCHEMBL17427393 0.90 POLB (0.49) POLBALDH1A1MMEL1HPGDLMNA
SCHEMBL17427401 0.88 POLB (0.42) POLBALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL17427408 0.87 POLB (0.41) POLBSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL17427407 0.87 POLB (0.49) POLBALDH1A1CYP1A2CYP2C9HPGD
SCHEMBL17430377 0.86 POLB (0.40) POLBSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL17427384 0.86 BRD9 (0.48) POLBALDH1A1SMN1; SMN2LMNAGRM5
SCHEMBL17222514 0.85 POLB (0.51) POLBALDH1A1SMN1; SMN2MMEL1MEN1
SCHEMBL17430275 0.84 IKBKE (0.40) POLBALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL17427457 0.84 POLB (0.48) POLBALDH1A1MMEL1CYP1A2CYP2C9

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 4093/4885ALDH1A1 79/4885SMN1; SMN2 4026/4885

“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.