SCHEMBL13664650

SCHEMBL13664650

Nc1ncc(-c2cccc(NC(=O)c3ccccc3N=O)c2)[nH]1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.64
SCN4A P35499 1/20 0.64
SCN3A Q9NY46 1/20 0.64
SCN5A Q14524 1/20 0.44
MASP2 O00187 1/20 0.44
MAPT P10636 3/20 0.41
TP53 P04637 2/20 0.41
ALDH1A1 P00352 3/20 0.40
HTT P42858 2/20 0.40
BACE1 P56817 2/20 0.40
NR2E3 Q9Y5X4 1/20 0.40
POLB P06746 2/20 0.39
KDM4E B2RXH2 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PRKCI P41743 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TDP1 Q9NUW8 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
SCHEMBL13655248 0.81 SCN4A (0.62) SCN9ASCN4ASCN3AMAPTALDH1A1
SCHEMBL20501030 0.80 SCN9A (0.61) SCN9ASCN4ASCN3ASCN5AMASP2
SCHEMBL20501076 0.79 SCN9A (0.61) SCN9ASCN4ASCN3AMASP2MAPT
SCHEMBL28368753 0.79 SCN9A (0.60) SCN9ASCN4ASCN3ASCN5AMASP2
SCHEMBL13655269 0.76 SCN9A (0.59) SCN9ASCN4ASCN3ASCN5AMASP2
SCHEMBL13655257 0.76 MAPT (0.58) SCN9ASCN4ASCN3AMAPTALDH1A1
SCHEMBL13655093 0.76 SCN4A (0.58) SCN9ASCN4ASCN3AMAPTTP53
SCHEMBL20501157 0.76 SCN9A (0.57) SCN9ASCN4ASCN3AMASP2
SCHEMBL20501016 0.74 SCN9A (0.55) SCN9ASCN4ASCN3ASCN5AMASP2
SCHEMBL20500943 0.74 SCN9A (0.55) SCN9ASCN4ASCN3AMASP2MAPT

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-20090270475-A1 INHIBITION OF BACTERIAL BIOFILMS WITH IMIDAZOLE-PHENYL DERIVATIVES NORTH CAROLINA STATE UNIVERSITY (US) 2009-10-29 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-20090270475-A1 INHIBITION OF BACTERIAL BIOFILMS WITH IMIDAZOLE-PHENYL DERIVATIVES TFPI, O60361, PGLS SCN9A 2854/4885SCN4A 4192/4885SCN3A 3773/4885

“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.