SCHEMBL16022005

SCHEMBL16022005

Cn1nnnc1NC(=O)c1nn(C)c(=O)n(-c2cccc(F)c2F)c1=O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.38
RIPK1 Q13546 5/20 0.35
LMNA P02545 1/20 0.35
SMURF1 Q9HCE7 2/20 0.35
KMT2A Q03164 2/20 0.34
P2RX7 Q99572 1/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
RAB9A P51151 1/20 0.34
MEN1 O00255 1/20 0.34
MET P08581 1/20 0.34
SCN9A Q15858 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33

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
SCHEMBL17427356 0.94 POLB (0.48) POLBMAPTRIPK1LMNASMURF1
SCHEMBL16022024 0.91 SMN1; SMN2 (0.40) POLBMAPTLMNANPC1ALDH1A1
SCHEMBL17427355 0.85 POLB (0.48) POLBMAPTLMNAALDH1A1RAB9A
SCHEMBL17427479 0.85 POLB (0.47) POLBMAPTLMNAKMT2AP2RX7
SCHEMBL17427392 0.84 POLB (0.43) POLBMAPTRIPK1LMNAKMT2A
SCHEMBL17427487 0.84 RIPK1 (0.35) POLBRIPK1LMNASMURF1KMT2A
SCHEMBL17427483 0.84 RIPK1 (0.36) POLBRIPK1LMNAKMT2AALDH1A1
SCHEMBL17427456 0.83 POLB (0.45) POLBMAPTRIPK1LMNASMURF1
SCHEMBL16022074 0.83 POLB (0.45) POLBMAPTLMNAKMT2AALDH1A1
SCHEMBL17427467 0.83 POLB (0.45) POLBRIPK1LMNASMURF1KMT2A

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 4093/4885MAPT 4184/4885RIPK1 4417/4885

“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.