SCHEMBL26420650

SCHEMBL26420650

COc1ccc2nccc(-c3cnc(OC)c(C)c3)c2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 3/20 0.60
AAK1 Q2M2I8 4/20 0.48
KDM4E B2RXH2 2/20 0.47
MAPK1 P28482 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
LMNA P02545 1/20 0.46
MTNR1A P48039 1/20 0.44
MTNR1B P49286 1/20 0.44
RIPK2 O43353 1/20 0.44
KDR P35968 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA1D P25100 1/20 0.44
ADRA1A P35348 1/20 0.44
ADRA1B P35368 1/20 0.44
PIK3CD O00329 1/20 0.42
KCNH2 Q12809 1/20 0.42
GRM4 Q14833 1/20 0.42
NCF1 P14598 1/20 0.41
PIK3CA P42336 1/20 0.41
CYP1A2 P05177 1/20 0.41

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
SCHEMBL15079353 0.86 AAK1 (0.49) TLR8AAK1KDM4EMAPK1NPSR1
SCHEMBL26420597 0.84 AAK1 (0.60) TLR8AAK1KDR
SCHEMBL23511777 0.78 TLR8 (0.62) TLR8AAK1KDM4ERIPK2KDR
SCHEMBL30440258 0.77 PIK3CA (0.57) TLR8KDM4EMAPK1NPSR1LMNA
SCHEMBL10157305 0.77 PIK3CA (0.57) TLR8KDM4EMAPK1NPSR1LMNA
SCHEMBL15056879 0.77 ESR1 (0.47) TLR8AAK1PIK3CDPIK3CA
SCHEMBL13191354 0.76 TLR8 (0.65) TLR8KDM4EMAPK1NPSR1LMNA
SCHEMBL2051073 0.76 MAP3K14 (0.57) TLR8KDM4EMAPK1NPSR1LMNA
SCHEMBL23511717 0.75 TLR8 (0.71) TLR8AAK1RIPK2KDRHTR1A
SCHEMBL1496335 0.75 LMNA (0.59) TLR8KDM4EMAPK1NPSR1LMNA

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-20230132035-A1 Toll-Like Receptor 8 (TLR8)-Specific Antagonists and Methods of Making and Uses Thereof UNIV COLORADO REGENTS (US) 2023-04-27 US disclosed
US-20230132035-A1 Toll-Like Receptor 8 (TLR8)-Specific Antagonists and Methods of Making and Uses Thereof UNIV COLORADO REGENTS (US) 2023-04-27 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-20230132035-A1 Toll-Like Receptor 8 (TLR8)-Specific Antagonists and Methods of Making and Uses Thereof TLR8, TLR3, TLR9 TLR8 1/4885AAK1 1668/4885KDM4E 3389/4885

“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.