SCHEMBL29314682

SCHEMBL29314682

Nc1nc2cc(-c3cc[nH]n3)ccc2c2cn(CCNC(=O)c3ccccc3F)nc12

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.37
TLR7 Q9NYK1 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
KMT2A Q03164 1/20 0.36
NQO2 P16083 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MAPT P10636 5/20 0.34
KDM4E B2RXH2 1/20 0.34
BCL3 P20749 1/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34
NAMPT P43490 1/20 0.34
BRD4 O60885 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
SCHEMBL29314692 0.89 L3MBTL1 (0.42) TLR8TLR7SMN1; SMN2KDM4ELMNA
SCHEMBL29320239 0.89 TLR7 (0.41) TLR8TLR7SMN1; SMN2KMT2AMAPT
SCHEMBL29314649 0.88 WNT1 (0.34) TLR8TLR7NAMPT
SCHEMBL29314632 0.87 ABL1 (0.45) NAMPT
SCHEMBL29314654 0.87 TLR8 (0.35) TLR8TLR7NAMPT
SCHEMBL29314687 0.87 NAMPT (0.39) TLR8TLR7MAPTKDM4ENAMPT
SCHEMBL29320672 0.86 TLR8 (0.37) TLR8TLR7NAMPT
SCHEMBL23037710 0.86 TLR7 (0.40) TLR8TLR7NAMPT
SCHEMBL29320279 0.86 KDM4E (0.38) TLR8TLR7SMN1; SMN2KMT2AHSD17B10
SCHEMBL29314668 0.85 NAMPT (0.35) TLR8TLR7NAMPT

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 TLR8 210/4885TLR7 236/4885SMN1; SMN2 4781/4885

“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.