SCHEMBL19857776

SCHEMBL19857776

Cc1ccc2c(c1)nc(C=O)n2COCC[Si](C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.38
NLRP3 Q96P20 1/20 0.38
TLR8 Q9NR97 1/20 0.36
VDR P11473 2/20 0.35
P2RX3 P56373 4/20 0.32
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
TYK2 P29597 1/20 0.32
JAK3 P52333 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TRPC5 Q9UL62 1/20 0.32
PDE10A Q9Y233 2/20 0.32
KDM4E B2RXH2 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAPT P10636 1/20 0.32
P2RX2 Q9UBL9 1/20 0.32
RAB9A P51151 1/20 0.31

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
SCHEMBL4073539 0.87 VDR (0.45) NPC1VDRALDH1A1KDM4EMAPT
SCHEMBL31174248 0.84 VDR (0.48) NPC1VDRALDH1A1KDM4EHSD17B10
SCHEMBL900164 0.84 VDR (0.48) NPC1VDRALDH1A1KDM4EHSD17B10
SCHEMBL31174250 0.84 VDR (0.48) NPC1VDRALDH1A1KDM4EHSD17B10
SCHEMBL3311841 0.81 MAPT (0.41) NPC1VDRMAPT
SCHEMBL19857729 0.79 TSHR (0.44) NPC1NLRP3TLR8P2RX3KDM4E
SCHEMBL5951467 0.79 NPC1 (0.41) NPC1NLRP3TLR8P2RX3JAK2
SCHEMBL5953236 0.76 NPC1 (0.39) NPC1NLRP3TLR8P2RX3JAK2
SCHEMBL5952387 0.75 TLR8 (0.42) NPC1NLRP3TLR8P2RX3JAK2
SCHEMBL23932593 0.74 VDR (0.35) NPC1VDRALDH1A1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10577349-B2 Quinolinones as inhibitors of translation initiation complex Sanford Burnham Prebys Medical Discovery Institute (US) 2020-03-03 US disclosed
US-10577349-B2 Quinolinones as inhibitors of translation initiation complex Sanford Burnham Prebys Medical Discovery Institute (US) 2020-03-03 US disclosed
US-20180044324-A1 Quinolinones as Inhibitors of Translation Initiation Complex Sanford Burnham Prebys Medical Discovery Institute 2018-02-15 US disclosed
US-20180044324-A1 Quinolinones as Inhibitors of Translation Initiation Complex Sanford Burnham Prebys Medical Discovery Institute 2018-02-15 US disclosed
US-20180044324-A1 Quinolinones as Inhibitors of Translation Initiation Complex Sanford Burnham Prebys Medical Discovery Institute 2018-02-15 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 (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-20180044324-A1 Quinolinones as Inhibitors of Translation Initiation Complex EIF4E, EIF4A1, EIF4A2 NPC1 2673/4885NLRP3 2850/4885TLR8 4353/4885
US-10577349-B2 Quinolinones as inhibitors of translation initiation complex EIF4E, EIF4A1, EIF4A2 NPC1 2673/4885NLRP3 2850/4885TLR8 4353/4885

“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.