SCHEMBL20549568

SCHEMBL20549568

COC(=O)c1c(O)c2cc(F)c(Br)c3c2n(c1=O)C(C)CC3

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 8/20 0.43
HIF1A Q16665 3/20 0.43
KDM4E B2RXH2 2/20 0.43
LMNA P02545 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HTT P42858 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
RAPGEF3 O95398 3/20 0.32
RAPGEF4 Q8WZA2 2/20 0.32

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
SCHEMBL20549787 0.90 TLR2 (0.38) TLR2HIF1AKDM4ELMNAALDH1A1
SCHEMBL20549259 0.82 LMNA (0.32) TLR2HIF1AKDM4ELMNAALDH1A1
SCHEMBL20549817 0.78 ALDH1A1 (0.34) TLR2HIF1AKDM4ELMNAALDH1A1
SCHEMBL20549436 0.78 TLR2 (0.38) TLR2HIF1AKDM4ELMNAALDH1A1
SCHEMBL20549184 0.73
SCHEMBL20549485 0.70 SCN5A (0.41) TLR2HIF1AKDM4ELMNAALDH1A1
SCHEMBL20549545 0.69 KDM4E (0.39) TLR2HIF1AKDM4ELMNAALDH1A1
SCHEMBL20549502 0.69 HIF1A (0.36) TLR2HIF1AKDM4ELMNAALDH1A1
SCHEMBL20549518 0.68 ALDH1A1 (0.33) KDM4ELMNAALDH1A1KMT2A
SCHEMBL23375383 0.68 MEN1 (0.61) TLR2HIF1AKDM4ELMNAALDH1A1

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-20180318311-A1 TRICYCLIC 2-QUINOLINONES AS ANTIBACTERIALS NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH INC. 2018-11-08 US disclosed
WO-2018203302-A1 TRICYCLIC 2-QUINOLINONES AS ANTIBACTERIALS NOVARTIS AG (CH) 2018-11-08 WO 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-20180318311-A1 TRICYCLIC 2-QUINOLINONES AS ANTIBACTERIALS TOP1, TOP2A, TOP2B TLR2 967/4885HIF1A 2739/4885KDM4E 2521/4885

“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.