SCHEMBL3099436

SCHEMBL3099436

CCCCc1cc2ccccc2[c]c1Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 8/20 0.42
BCHE P06276 2/20 0.35
TLR7 Q9NYK1 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33

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
SCHEMBL2200831 0.86 TLR8 (0.47) TLR8CNR2
SCHEMBL9128868 0.82 BCL2 (0.42)
SCHEMBL5500478 0.82 TLR8 (0.47) TLR8
SCHEMBL6698577 0.81 TLR8 (0.49) TLR8
SCHEMBL560035 0.80 TLR8 (0.48) TLR8
SCHEMBL20694916 0.80 TLR8 (0.48) TLR8
SCHEMBL158196 0.80 TLR8 (0.48) TLR8
SCHEMBL9065394 0.80 TLR8 (0.48) TLR8
SCHEMBL3403921 0.80 TLR8 (0.48) TLR8
SCHEMBL11512512 0.77 TLR8 (0.45) TLR8BCHE

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-20100273835-A1 NOVEL COMPOUNDS PROBIODRUG AG (DE) 2010-10-28 US disclosed
EP-2178830-A2 NOVEL COMPOUNDS Probiodrug AG (DE) 2010-04-28 EP disclosed
WO-2009007415-A2 NOVEL COMPOUNDS PROBIODRUG AG (DE) 2009-01-15 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-20100273835-A1 NOVEL COMPOUNDS IL6, PREP, PEPD TLR8 2465/4885BCHE 565/4885TLR7 1162/4885

“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.