SCHEMBL1935230

SCHEMBL1935230

COc1ccc(C(F)(F)F)c(-c2ccnc(C(N)=NO)c2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.40
PLAU P00749 2/20 0.37
NTRK1 P04629 1/20 0.37
PIM1 P11309 1/20 0.37
TEK Q02763 1/20 0.36
DYRK1A Q13627 2/20 0.36
GSK3B P49841 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
CYP2C19 P33261 1/20 0.35
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
NPC1 O15118 1/20 0.35
PKM P14618 1/20 0.35
RAB9A P51151 1/20 0.35
SCN9A Q15858 2/20 0.35
CYP2C9 P11712 1/20 0.35
SCN5A Q14524 1/20 0.35

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
SCHEMBL12439827 1.00 GAA (0.40) GAAPLAUNTRK1PIM1TEK
SCHEMBL12439761 0.91 GAA (0.43) GAAPLAUNTRK1PIM1DYRK1A
SCHEMBL1934820 0.91 GAA (0.43) GAAPLAUNTRK1PIM1DYRK1A
SCHEMBL13382640 0.86 PLAU (0.38) PLAUTEKDYRK1AGSK3BCYP1A2
SCHEMBL12439817 0.84 SCN9A (0.38) GAAPLAUNTRK1PIM1CYP3A4
SCHEMBL1935777 0.84 SCN9A (0.44) GAACYP3A4CYP11B2NPC1RAB9A
SCHEMBL12439797 0.84 SCN9A (0.44) GAACYP3A4CYP11B2NPC1RAB9A
SCHEMBL1935109 0.83 SCN9A (0.49) GAADYRK1ACYP1A2CYP3A4CYP2C19
SCHEMBL12514481 0.83 SCN9A (0.49) GAADYRK1ACYP1A2CYP3A4CYP2C19
SCHEMBL1934839 0.80 SCN9A (0.48) GAACYP1A2CYP3A4TSHRCYP2C19

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 GAA 4246/4885PLAU 4355/4885NTRK1 4224/4885

“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.