SCHEMBL19783862

SCHEMBL19783862

Cn1c(=O)n(CC2CC2)c(=O)n1-c1cnc2nn(-c3cccnc3)cc2c1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.36
MAT2A P31153 3/20 0.36
USP1 O94782 3/20 0.35
CNR2 P34972 2/20 0.34
ADORA2A P29274 1/20 0.32
ADORA2B P29275 1/20 0.32
ADORA1 P30542 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ELANE P08246 1/20 0.31
PIK3CA P42336 1/20 0.31
PDE10A Q9Y233 1/20 0.31
GHSR Q92847 2/20 0.31

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
SCHEMBL21422264 0.88 ADORA2A (0.39) TLR8MAT2AADORA2AADORA2BADORA1
SCHEMBL19783857 0.86 TLR8 (0.36) TLR8MAT2AUSP1CNR2ADORA2A
SCHEMBL19783861 0.84 TLR8 (0.38) TLR8MAT2AELANE
SCHEMBL21422265 0.83 TLR8 (0.43) TLR8MAT2AADORA2AADORA2BADORA1
SCHEMBL21422274 0.80 TLR8 (0.39) TLR8MAT2AADORA2AADORA2BADORA1
SCHEMBL19783865 0.74 TLR8 (0.39) TLR8MAT2AALDH1A1LMNA
SCHEMBL21422266 0.73 ADORA2A (0.39) TLR8MAT2AADORA2AADORA2BADORA1
SCHEMBL19783855 0.73 ADORA2A (0.40) TLR8MAT2AADORA2AADORA2BADORA1
SCHEMBL19342601 0.71 CYP2A6 (0.43) TLR8
SCHEMBL21422279 0.70 ALDH1A1 (0.39) TLR8ADORA2AALDH1A1LMNAL3MBTL1

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 3552/4885MAT2A 3274/4885USP1 3144/4885

“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.