SCHEMBL25628534

SCHEMBL25628534

CCCc1nc2c(NC(C)C)nc3ccccc3c2s1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 17/20 0.69
TLR7 Q9NYK1 12/20 0.63
ADORA3 P0DMS8 1/20 0.45
APP P05067 1/20 0.44
MAPT P10636 1/20 0.43
NPSR1 Q6W5P4 1/20 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
SCHEMBL24052314 0.86 TLR8 (0.73) TLR8TLR7ADORA3MAPTNPSR1
SCHEMBL25627708 0.82 TLR8 (0.69) TLR8TLR7ADORA3MAPTNPSR1
SCHEMBL26100478 0.81 TLR8 (0.83) TLR8TLR7ADORA3MAPTNPSR1
SCHEMBL24052764 0.79 TLR8 (0.72) TLR8TLR7MAPTNPSR1
SCHEMBL482958 0.78 TLR8 (1.00) TLR8TLR7
SCHEMBL29373816 0.78 TLR8 (1.00) TLR8TLR7
SCHEMBL4540442 0.78 TLR8 (0.74) TLR8TLR7ADORA3
Hydrochloric Acid SCHEMBL5765916 0.76 TLR8 (0.97) TLR8TLR7
SCHEMBL4540446 0.76 TLR8 (0.88) TLR8TLR7ADORA3
SCHEMBL24052769 0.76 TLR8 (0.88) TLR8TLR7

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230181743-A1 FUNCTIONAL LIPID DERIVATIVES AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-06-15 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-20230181743-A1 FUNCTIONAL LIPID DERIVATIVES AND USES THEREOF LIPA, LIPG, LIPC TLR8 531/4885TLR7 1104/4885ADORA3 1170/4885

“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.