SCHEMBL19783860

SCHEMBL19783860

Cn1c(=O)n(C2CC2)c(=O)n1-c1ccc2nn(-c3cccnc3)cc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.38
CYP11B2 P19099 9/20 0.37
CYP11B1 P15538 8/20 0.37
KCNH2 Q12809 1/20 0.35
ATM Q13315 1/20 0.35
ATR Q13535 1/20 0.35
ESR2 Q92731 1/20 0.34
MAT2A P31153 2/20 0.34
MTOR P42345 1/20 0.33
USP2 O75604 2/20 0.33
ALDH1A1 P00352 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2C9 P11712 2/20 0.33
TSHR P16473 2/20 0.33
CYP3A4 P08684 1/20 0.33
MAPK1 P28482 1/20 0.32
CYP2C19 P33261 1/20 0.32
HSD17B10 Q99714 1/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32

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
SCHEMBL19783990 0.85 TLR8 (0.44) TLR8CYP11B2CYP11B1ESR2MAT2A
SCHEMBL19783861 0.85 TLR8 (0.38) TLR8CYP11B2CYP11B1KCNH2ATM
SCHEMBL19783857 0.83 TLR8 (0.36) TLR8ESR2MAT2AALDH1A1
SCHEMBL19783856 0.82 ESR2 (0.41) TLR8ESR2MAT2AALDH1A1MAPK1
SCHEMBL19783855 0.82 ADORA2A (0.40) TLR8CYP11B2CYP11B1ESR2MAT2A
SCHEMBL19784126 0.82 TLR8 (0.39) TLR8CYP11B2CYP11B1ESR2MAT2A
SCHEMBL19783293 0.81 TLR8 (0.36) TLR8ESR2
SCHEMBL21422279 0.79 ALDH1A1 (0.39) TLR8CYP11B2ESR2ALDH1A1CYP1A2
SCHEMBL21422263 0.78 TLR8 (0.37) TLR8CYP11B2ESR2MAT2A
SCHEMBL19783289 0.78 TLR8 (0.37) TLR8ESR2MAT2AUSP2ALDH1A1

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
EP-3484877-B1 BICYCLIC COMPOUNDS AS PEST CONTROLLERS BAYER CROPSCIENCE AG (DE) 2020-07-01 EP disclosed
US-20190297887-A1 BICYCLIC COMPOUNDS AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-10-03 US disclosed
WO-2018011111-A1 BICYCLIC COMPOUNDS AS PEST CONTROL AGENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-01-18 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-20190297887-A1 BICYCLIC COMPOUNDS AS PESTICIDES DDT, BCHE, ACHE TLR8 3552/4885CYP11B2 87/4885CYP11B1 117/4885

“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.