SCHEMBL20549371

SCHEMBL20549371

C[C@H]1CNc2c(Br)c(F)cc3cc(C(=O)O)c(=O)n1c23

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 1/20 0.38
KCNH2 Q12809 2/20 0.33
KDM4E B2RXH2 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP1A2 P05177 1/20 0.33
LMNA P02545 1/20 0.31
TOP2A P11388 1/20 0.30
TOP2B Q02880 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
SCHEMBL20549485 0.79 SCN5A (0.41) SCN5AKCNH2KDM4ESMN1; SMN2CYP1A2
SCHEMBL20549502 0.78 HIF1A (0.36) KDM4ELMNA
SCHEMBL20549418 0.77 KCNH2 (0.48) SCN5AKCNH2KDM4ESMN1; SMN2CYP1A2
SCHEMBL20549899 0.77 TOP2A (0.43) SCN5AKCNH2KDM4ESMN1; SMN2CYP1A2
Hydrochloric Acid SCHEMBL20549561 0.74 SCN5A (0.67) SCN5AKCNH2KDM4ELMNA
Hydrochloric Acid SCHEMBL20552385 0.74 SCN5A (0.67) SCN5AKCNH2KDM4ELMNA
SCHEMBL17494296 0.73 SCN5A (0.57) SCN5AKCNH2TOP2ATOP2B
SCHEMBL20549202 0.70 KCNH2 (0.50) SCN5AKCNH2KDM4ESMN1; SMN2CYP1A2
SCHEMBL20549518 0.68 ALDH1A1 (0.33) SCN5AKCNH2KDM4ELMNA
SCHEMBL20549817 0.67 ALDH1A1 (0.34) SCN5AKCNH2KDM4ESMN1; SMN2LMNA

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 SCN5A 1467/4885KCNH2 2920/4885KDM4E 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.