SCHEMBL8426489

SCHEMBL8426489

CCCCCCCCCCn1c(CC)cc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 4/20 0.50
CNR2 P34972 6/20 0.45
TP53 P04637 2/20 0.45
OXER1 Q8TDS5 4/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
CNR1 P21554 2/20 0.43

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
SCHEMBL10412903 1.00 TLR8 (0.50) TLR8CNR2TP53OXER1MAPT
SCHEMBL10693099 1.00 TLR8 (0.50) TLR8CNR2TP53OXER1MAPT
SCHEMBL21278119 0.98 TLR8 (0.49) TLR8CNR2TP53OXER1CNR1
SCHEMBL10413631 0.89 TLR8 (0.49) TLR8CNR2TP53OXER1
SCHEMBL3847993 0.87 OXER1 (0.51) TLR8CNR2TP53OXER1CNR1
SCHEMBL6211295 0.86 CNR2 (0.47) TLR8CNR2TP53OXER1CNR1
SCHEMBL10413247 0.82 MEN1 (0.56) TLR8CNR2TP53MAPTSMN1; SMN2
SCHEMBL11153101 0.82 MEN1 (0.56) TLR8CNR2TP53MAPTSMN1; SMN2
SCHEMBL11607923 0.82 MEN1 (0.56) TLR8CNR2TP53MAPTSMN1; SMN2
SCHEMBL4212491 0.82 MEN1 (0.56) TLR8CNR2TP53MAPTSMN1; SMN2

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-20080119395-A1 Novel Depsipeptides and Process for Preparing Same CUBIST PHARMACEUTICALS, INC. 2008-05-22 US disclosed
US-20060194714-A1 Novel depsipeptides and process for preparing same CUBIST PHARMACEUTICALS, INC. 2006-08-31 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 (2 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-20060194714-A1 Novel depsipeptides and process for preparing same VIP, DNPEP, PREP TLR8 3157/4885CNR2 4752/4885TP53 3982/4885
US-20080119395-A1 Novel Depsipeptides and Process for Preparing Same VIP, DNPEP, PREP TLR8 3157/4885CNR2 4752/4885TP53 3982/4885

“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.