SCHEMBL19200450

SCHEMBL19200450

Cc1c(N2CCCC(NCl)C2)c(F)cc2cc(C(=O)O)c(=O)n(C3CC3)c12

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 1/20 0.64
KCNH2 Q12809 12/20 0.55
BTK Q06187 4/20 0.38
EGFR P00533 1/20 0.38
TEC P42680 1/20 0.38
TXK P42681 1/20 0.38
BMX P51813 1/20 0.38
JAK3 P52333 1/20 0.38
ITK Q08881 1/20 0.38
ERBB4 Q15303 1/20 0.38

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
SCHEMBL19194829 0.87 SCN5A (0.68) SCN5AKCNH2
SCHEMBL19195294 0.86 SCN5A (0.70) SCN5AKCNH2
SCHEMBL17494378 0.86 SCN5A (0.58) SCN5AKCNH2BTKEGFRTEC
Hydrochloric Acid SCHEMBL17494242 0.85 SCN5A (0.69) SCN5AKCNH2
SCHEMBL19200553 0.83 SCN5A (0.66) SCN5AKCNH2
SCHEMBL19200407 0.83 SCN5A (0.66) SCN5AKCNH2
SCHEMBL19200476 0.83 SCN5A (0.66) SCN5AKCNH2
SCHEMBL19194828 0.83 SCN5A (0.73) SCN5AKCNH2
SCHEMBL19194871 0.82 SCN5A (0.75) SCN5AKCNH2
SCHEMBL19194740 0.81 SCN5A (0.68) SCN5AKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170217897-A1 QUINOLONE DERIVATIVES AS ANTIBACTERIALS WUXI APPTEC (CN) 2017-08-03 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-20170217897-A1 QUINOLONE DERIVATIVES AS ANTIBACTERIALS TOP1, NQO2, TOP2A SCN5A 1288/4885KCNH2 3467/4885BTK 1024/4885

“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.