SCHEMBL12514481

SCHEMBL12514481

N/C(=N\O)c1cc(-c2cc(C(F)(F)F)ccc2C(F)(F)F)ccn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 6/20 0.49
CYP2C9 P11712 3/20 0.49
SCN5A Q14524 1/20 0.49
CYP3A4 P08684 2/20 0.43
CYP2D6 P10635 1/20 0.43
JAK2 O60674 1/20 0.40
DYRK1A Q13627 1/20 0.38
NOS3 P29474 1/20 0.36
NOS2 P35228 1/20 0.36
CES2 O00748 1/20 0.35
ALOX5AP P20292 2/20 0.34
FEN1 P39748 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MAPK1 P28482 1/20 0.34
SCN10A Q9Y5Y9 1/20 0.34
PTGER1 P34995 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
NPC1 O15118 1/20 0.34
GAA P10253 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL1935109 1.00 SCN9A (0.49) SCN9ACYP2C9SCN5ACYP3A4CYP2D6
SCHEMBL1934577 0.90 ALOX5AP (0.44) SCN9ACYP2C9SCN5ACYP3A4CYP2D6
SCHEMBL12439755 0.90 ALOX5AP (0.44) SCN9ACYP2C9SCN5ACYP3A4CYP2D6
SCHEMBL12439797 0.88 SCN9A (0.44) SCN9ACYP2C9SCN5ACYP3A4CYP2D6
SCHEMBL1935777 0.88 SCN9A (0.44) SCN9ACYP2C9SCN5ACYP3A4CYP2D6
SCHEMBL12514346 0.87 MPL (0.43) SCN9ACYP2C9SCN5ADYRK1ANOS3
SCHEMBL1935599 0.87 MPL (0.43) SCN9ACYP2C9SCN5ADYRK1ANOS3
SCHEMBL12439817 0.86 SCN9A (0.38) SCN9ACYP2C9SCN5ACYP3A4CYP2D6
SCHEMBL12439802 0.86 ALDH1A1 (0.43) SCN9ACYP2C9SCN5ACYP3A4JAK2
SCHEMBL1935305 0.86 ALDH1A1 (0.43) SCN9ACYP2C9SCN5ACYP3A4JAK2

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
EP-2332936-B1 PYRIDINE COMPOUND AND USE THEREOF FOR PEST CONTROL SUMITOMO CHEMICAL CO (JP) 2013-09-04 EP disclosed
US-20110178132-A1 PYRIDINE COMPOUND AND USE THEREOF FOR PEST CONTROL SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2011-07-21 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-20110178132-A1 PYRIDINE COMPOUND AND USE THEREOF FOR PEST CONTROL C5, PRDX1, PRDX4 SCN9A 3140/4885CYP2C9 341/4885SCN5A 2328/4885

“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.