SCHEMBL17427397

SCHEMBL17427397

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.44
LMNA P02545 1/20 0.40
RAB9A P51151 3/20 0.37
NPC1 O15118 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.36
RXFP1 Q9HBX9 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
HIF1A Q16665 1/20 0.36
MET P08581 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GSK3A P49840 1/20 0.34
GSK3B P49841 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
BCHE P06276 1/20 0.34
CHRNE Q04844 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
SCHEMBL17427393 0.89 POLB (0.49) POLBLMNACTDSP1L3MBTL1ALDH1A1
SCHEMBL16022000 0.89 MET (0.44) POLBLMNAMETSMN1; SMN2
SCHEMBL17222514 0.88 POLB (0.51) POLBLMNARAB9ANPC1CTDSP1
SCHEMBL17427398 0.87 POLB (0.43) POLBLMNACTDSP1RXFP1NPSR1
SCHEMBL17427383 0.87 POLB (0.42) POLBLMNARAB9ANPC1CTDSP1
SCHEMBL17427386 0.87 POLB (0.42) POLBRAB9ACTDSP1METMEN1
SCHEMBL17430284 0.87 POLB (0.42) POLBLMNARAB9ANPC1CYP2C9
SCHEMBL17427411 0.87 POLB (0.45) POLBRAB9ANPC1CTDSP1MET
SCHEMBL17430384 0.86 POLB (0.41) POLBCTDSP1METMEN1KMT2A
SCHEMBL17427455 0.86 POLB (0.41) POLBLMNARAB9ACTDSP1MET

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 4093/4885LMNA 3606/4885RAB9A 2062/4885

“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.