SCHEMBL16022014

SCHEMBL16022014

Cn1nnnc1NC(=O)c1nn(C)c(=O)n(Cc2ccccc2)c1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.51
PKM P14618 3/20 0.42
ALDH1A1 P00352 3/20 0.42
EEF2K O00418 2/20 0.42
S1PR2 O95136 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
MAPT P10636 4/20 0.39
GAA P10253 2/20 0.39
HIF1A Q16665 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
RAB9A P51151 1/20 0.38
HPGD P15428 1/20 0.38
LMNA P02545 2/20 0.38
MMEL1 Q495T6 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL16022065 0.91 POLB (0.47) POLBALDH1A1KMT2AMAPTSMN1; SMN2
SCHEMBL17427414 0.90 POLB (0.45) POLBALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL17427427 0.89 POLB (0.44) POLBPKMALDH1A1MEN1KMT2A
SCHEMBL17427412 0.89 MAPT (0.43) POLBALDH1A1EEF2KMEN1KMT2A
SCHEMBL17427423 0.88 PCSK9 (0.42) POLBPKMALDH1A1MAPTSMN1; SMN2
SCHEMBL17427424 0.87 POLB (0.56) POLBALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL17427441 0.86 POLB (0.42) POLBALDH1A1EEF2KKMT2AGAA
SCHEMBL17427416 0.86 POLB (0.42) POLBGAASMN1; SMN2HDAC1HDAC8
SCHEMBL17427428 0.86 GAA (0.50) POLBPKMALDH1A1MAPTGAA
SCHEMBL17427420 0.86 P2RX3 (0.42) POLBALDH1A1MEN1KMT2AHIF1A

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 4093/4885PKM 2217/4885ALDH1A1 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.