SCHEMBL1935601

SCHEMBL1935601

NC(=NO)c1cc(-c2ccc(Cl)cc2C(F)(F)F)ccn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.44
AKR1C3 P42330 1/20 0.40
AKR1C2 P52895 1/20 0.40
EEF2K O00418 1/20 0.40
PLK1 P53350 1/20 0.40
KDM4C Q9H3R0 1/20 0.38
GRM5 P41594 1/20 0.35
JAK2 O60674 1/20 0.35
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
SCN10A Q9Y5Y9 1/20 0.34
GCGR P47871 3/20 0.34
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL12439765 1.00 SCN9A (0.44) SCN9AAKR1C3AKR1C2EEF2KPLK1
SCHEMBL12439786 0.87 TRPA1 (0.43) SCN9AAKR1C3AKR1C2GRM5NPC1
SCHEMBL1935000 0.87 TRPA1 (0.43) SCN9AAKR1C3AKR1C2GRM5NPC1
SCHEMBL12439755 0.86 ALOX5AP (0.44) SCN9AAKR1C3AKR1C2ALDH1A1SCN10A
SCHEMBL1934577 0.86 ALOX5AP (0.44) SCN9AAKR1C3AKR1C2ALDH1A1SCN10A
SCHEMBL12439746 0.83 SCN9A (0.48) SCN9ANPC1RAB9AALDH1A1SCN10A
SCHEMBL1934839 0.83 SCN9A (0.48) SCN9ANPC1RAB9AALDH1A1SCN10A
SCHEMBL12439761 0.81 GAA (0.43) SCN9AAKR1C3AKR1C2NPC1RAB9A
SCHEMBL1934820 0.81 GAA (0.43) SCN9AAKR1C3AKR1C2NPC1RAB9A
SCHEMBL1935777 0.79 SCN9A (0.44) SCN9ANPC1RAB9ASCN10AGAA

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 3 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
EP-2332936-A1 PYRIDINE COMPOUND AND USE THEREOF FOR PEST CONTROL Sumitomo Chemical Company, Limited (JP) 2011-06-15 EP 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 3140/4885AKR1C3 475/4885AKR1C2 1383/4885

“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.