SCHEMBL6400852

SCHEMBL6400852

Fc1cc(-c2nocc2CNc2ccon2)cc(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 6/20 0.34
SCN8A Q9UQD0 6/20 0.34
SCN5A Q14524 5/20 0.34
DYRK1A Q13627 1/20 0.34
CLK4 Q9HAZ1 1/20 0.34
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 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
SCHEMBL4679278 0.76 IGF1R (0.37) SMN1; SMN2
SCHEMBL6446487 0.72 GAA (0.36) SCN1ASCN8ASCN5AGAASMN1; SMN2
SCHEMBL6400853 0.61 GAA (0.30) GAASMN1; SMN2
SCHEMBL29949208 0.60 BACE1 (0.35) SCN1ASCN8ASCN5ASMN1; SMN2
SCHEMBL20558244 0.59 APLNR (0.56) CLK4
SCHEMBL10517118 0.59 ATM (0.36) GAASMN1; SMN2
SCHEMBL5803747 0.59
SCHEMBL4826043 0.59
SCHEMBL5774132 0.58 KMO (0.36)
Hydrochloric Acid SCHEMBL14743836 0.57

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-20050014806-A1 Substituted isoxazoles and their use as antibiotics LABORATORIOS S.A.L.V.A.T., S.A. (ES) 2005-01-20 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-20050014806-A1 Substituted isoxazoles and their use as antibiotics XDH, SCO2, HAX1 SCN1A 1417/4885SCN8A 3243/4885SCN5A 2427/4885

“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.