SCHEMBL17427485

SCHEMBL17427485

CCCCn1c(=O)c(C(=O)Nc2ncnn2C)nn(C)c1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 6/20 0.38
PDE4B Q07343 6/20 0.38
PDE4C Q08493 6/20 0.38
PDE4D Q08499 6/20 0.38
ADORA2A P29274 4/20 0.38
ADORA2B P29275 2/20 0.38
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 2/20 0.37
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
TSHR P16473 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MAPT P10636 1/20 0.36
TNF P01375 2/20 0.35
MET P08581 2/20 0.35
AXL P30530 2/20 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
SCHEMBL16022015 0.81 CNR2 (0.38) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL17427489 0.80 PDE4A (0.38) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL17427381 0.80 POLB (0.41) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL16116321 0.73 ALDH1A1 (0.43) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL16022044 0.69 TNF (0.49) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL17427443 0.65 POLB (0.41) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL23022737 0.65 L3MBTL1 (0.44) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL19980639 0.64 GRM5 (0.33) MEN1KMT2AALDH1A1KDM4ETSHR
SCHEMBL21246173 0.64 NR3C2 (0.35) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL16022004 0.63 POLB (0.46) PDE4APDE4BPDE4CPDE4DADORA2A

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 PDE4A 634/4885PDE4B 389/4885PDE4C 539/4885

“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.