SCHEMBL19857729

SCHEMBL19857729

Cc1ccc2c(c1)nc(CO)n2COCC[Si](C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
TNF P01375 1/20 0.44
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
NPC1 O15118 2/20 0.39
NLRP3 Q96P20 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TLR8 Q9NR97 1/20 0.37
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
NPSR1 Q6W5P4 2/20 0.36
TP53 P04637 1/20 0.36
P2RX3 P56373 1/20 0.35
RPS6KA5 O75582 1/20 0.34

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
SCHEMBL29117187 0.90 TSHR (0.44) TSHRTNFRAB9ASMN1; SMN2NPC1
SCHEMBL29979732 0.90 TSHR (0.44) TSHRTNFRAB9ASMN1; SMN2NPC1
SCHEMBL2655223 0.83 SMN1; SMN2 (0.52) TSHRTNFRAB9ASMN1; SMN2NPC1
SCHEMBL5951467 0.80 NPC1 (0.41) RAB9ANPC1NLRP3KMT2AKDM4E
SCHEMBL19857776 0.79 NPC1 (0.38) RAB9ANPC1NLRP3KDM4EHSD17B10
SCHEMBL638300 0.79 RPS6KA5 (0.45) RAB9ANPC1KMT2AKDM4EHSD17B10
SCHEMBL29979676 0.78 TLR8 (0.40) TSHRTNFRAB9ASMN1; SMN2NPC1
SCHEMBL5953236 0.77 NPC1 (0.39) RAB9ASMN1; SMN2NPC1NLRP3MEN1
SCHEMBL5952387 0.76 TLR8 (0.42) RAB9ANPC1NLRP3MEN1KMT2A
SCHEMBL25140338 0.75 KMT2A (0.41) NPC1MEN1KMT2ATP53

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 TSHR 4641/4885TNF 4448/4885RAB9A 1120/4885
US-10577349-B2 Quinolinones as inhibitors of translation initiation complex EIF4E, EIF4A1, EIF4A2 TSHR 4641/4885TNF 4448/4885RAB9A 1120/4885

“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.