SCHEMBL29314707

SCHEMBL29314707

Nc1nc2cc(-c3cc[nH]n3)ccc2c2cn(CCNC(=O)c3ccc(F)c(Cl)n3)nc12

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.33
TLR8 Q9NR97 1/20 0.32
TLR7 Q9NYK1 1/20 0.32
MAPT P10636 2/20 0.31
MALT1 Q9UDY8 1/20 0.30
IRAK4 Q9NWZ3 1/20 0.30
SCN9A Q15858 1/20 0.30
ABL1 P00519 1/20 0.30
BCR P11274 1/20 0.30
MAP4K4 O95819 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30

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
SCHEMBL29314678 0.89 MAOB (0.38) NAMPTTLR8TLR7MAPTMALT1
SCHEMBL30539908 0.89 NAMPT (0.37) NAMPTTLR8TLR7MAPTSCN9A
SCHEMBL23037521 0.89 NAMPT (0.37) NAMPTTLR8TLR7MAPTSCN9A
SCHEMBL29314654 0.88 TLR8 (0.35) NAMPTTLR8TLR7SCN9AABL1
SCHEMBL29320594 0.88 TLR8 (0.35) NAMPTTLR8TLR7IRAK4MAP4K4
SCHEMBL29314663 0.87 KDR (0.34) NAMPTTLR8TLR7MAPT
SCHEMBL29314700 0.87 NAMPT (0.33) NAMPTTLR8TLR7ABL1BCR
SCHEMBL29314642 0.86 TLR8 (0.36) NAMPTTLR8TLR7MAPTIRAK4
SCHEMBL29314715 0.85 MAPT (0.36) NAMPTTLR8TLR7MAPTABL1
SCHEMBL29314651 0.85 NAMPT (0.36) NAMPTTLR8TLR7MAPTSCN9A

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-12037344-B2 NLRP3 modulators INNATE TUMOR IMMUNITY, INC (US) 2024-07-16 US disclosed
US-12037344-B2 NLRP3 modulators INNATE TUMOR IMMUNITY, INC (US) 2024-07-16 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-12037344-B2 NLRP3 modulators NLRP3, NLRP1, PYCARD NAMPT 122/4885TLR8 210/4885TLR7 236/4885

“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.