SCHEMBL17427482

SCHEMBL17427482

Cn1ncnc1NC(=O)c1nn(C)c(=O)n(-c2ccccc2)c1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYRO3 Q06418 1/20 0.38
RIPK1 Q13546 5/20 0.38
ALDH1A1 P00352 4/20 0.37
POLB P06746 2/20 0.37
PKM P14618 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
RAB9A P51151 2/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
KMT2A Q03164 1/20 0.36
GAA P10253 1/20 0.36
MET P08581 1/20 0.36
HTT P42858 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
MAPT P10636 1/20 0.35
RECQL P46063 1/20 0.35
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
PGR P06401 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
SCHEMBL17427483 0.82 RIPK1 (0.36) RIPK1ALDH1A1POLBMEN1KMT2A
SCHEMBL17427475 0.81 TYRO3 (0.41) TYRO3RAB9AMEN1KMT2AMET
SCHEMBL17222514 0.81 POLB (0.51) RIPK1ALDH1A1POLBPKMSMN1; SMN2
SCHEMBL17427486 0.80 CTDSP1 (0.39) RIPK1ALDH1A1POLBPKMSMN1; SMN2
SCHEMBL16022045 0.76 RIPK1 (0.37) RIPK1ALDH1A1POLBPKMSMN1; SMN2
SCHEMBL248654 0.76 GSK3A (0.47) ALDH1A1POLBPKMSMN1; SMN2RAB9A
SCHEMBL17054072 0.75 SMN1; SMN2 (0.41) RIPK1ALDH1A1POLBPKMSMN1; SMN2
SCHEMBL17427485 0.74 PDE4A (0.38) ALDH1A1PKMSMN1; SMN2MEN1KMT2A
SCHEMBL14877423 0.74 GSK3A (0.44) ALDH1A1POLBPKMSMN1; SMN2RAB9A
SCHEMBL17427391 0.70 POLB (0.50) RIPK1ALDH1A1POLBPKMSMN1; SMN2

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 TYRO3 4178/4885RIPK1 4417/4885ALDH1A1 79/4885

“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.