SCHEMBL17427356

SCHEMBL17427356

Cn1nnnc1NC(=O)c1nn(C)c(=O)n(-c2ccccc2F)c1=O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.48
SMURF1 Q9HCE7 3/20 0.39
MET P08581 1/20 0.38
RIPK1 Q13546 5/20 0.38
KMT2A Q03164 2/20 0.38
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
MAPT P10636 2/20 0.37
LMNA P02545 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
RECQL P46063 1/20 0.35
MEN1 O00255 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
SCHEMBL16022005 0.94 POLB (0.44) POLBSMURF1METRIPK1KMT2A
SCHEMBL17427355 0.89 POLB (0.48) POLBRAB9AALDH1A1MAPTLMNA
SCHEMBL16022074 0.87 POLB (0.45) POLBKMT2ARAB9AALDH1A1HTT
SCHEMBL17427467 0.87 POLB (0.45) POLBSMURF1METRIPK1KMT2A
SCHEMBL17427456 0.87 POLB (0.45) POLBSMURF1RIPK1ALDH1A1MAPT
SCHEMBL17222514 0.85 POLB (0.51) POLBRIPK1KMT2ARAB9ANPC1
SCHEMBL16022024 0.84 SMN1; SMN2 (0.40) POLBRAB9ANPC1ALDH1A1HPGD
SCHEMBL16022000 0.83 MET (0.44) POLBMETLMNA
SCHEMBL17427462 0.83 POLB (0.40) POLBSMURF1METHTTMAPT
SCHEMBL17430377 0.82 POLB (0.40) POLBMETRIPK1KMT2AHTT

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 4093/4885SMURF1 3721/4885MET 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.