SCHEMBL1936965

SCHEMBL1936965

O=C(O)c1cccc2c(C3=NOC(c4cc(Cl)cc(Cl)c4)(C(F)(F)F)C3)cccc12

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 4/20 0.34
HSP90AA1 P07900 1/20 0.33
FABP3 P05413 1/20 0.32
PDK2 Q15119 2/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
TYMS P04818 1/20 0.32
ITGB1 P05556 1/20 0.31
ITGA4 P13612 1/20 0.31
HPGD P15428 1/20 0.31
DHODH Q02127 1/20 0.31
NR4A1 P22736 1/20 0.31
NR4A2 P43354 1/20 0.31
NR4A3 Q92570 1/20 0.31
MPO P05164 1/20 0.31
PSD A5PKW4 1/20 0.31
ACLY P53396 1/20 0.31
ORAI1 Q96D31 1/20 0.31

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
SCHEMBL871382 0.94 PDK2 (0.36) PDK2CA1CA2TYMSHPGD
SCHEMBL21863425 0.94 PDK2 (0.36) PDK2CA1CA2TYMSHPGD
SCHEMBL31366944 0.90 SYK (0.36) FABP4HSP90AA1FABP3PDK2CA1
SCHEMBL870417 0.88 PDK2 (0.34) FABP4PDK2CA1CA2DHODH
SCHEMBL1938202 0.87 PDK2 (0.33) PDK2CA1CA2HPGD
SCHEMBL30313890 0.87 ACLY (0.38) PDK2DHODHMPOACLYORAI1
SCHEMBL13458407 0.87 PDK2 (0.33) PDK2DHODHORAI1
SCHEMBL2780339 0.87 ACLY (0.38) PDK2DHODHMPOACLYORAI1
SCHEMBL1936766 0.86 TYMS (0.32) PDK2CA1CA2TYMSORAI1
SCHEMBL737447 0.85 PDK2 (0.39) FABP4PDK2DHODHPSD

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9216973-B2 Insecticidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2015-12-22 US disclosed
US-9216973-B2 Insecticidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2015-12-22 US disclosed
US-9216973-B2 Insecticidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2015-12-22 US disclosed
EP-2331536-B1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-08-21 EP disclosed
EP-2331536-B1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-08-21 EP disclosed
US-20130165485-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2013-06-27 US disclosed
US-20130165485-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2013-06-27 US disclosed
US-20130165485-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2013-06-27 US disclosed
US-20110269804-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2011-11-03 US disclosed
US-20110269804-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2011-11-03 US disclosed
US-20110269804-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2011-11-03 US disclosed
EP-2331536-A1 INSECTICIDAL COMPOUNDS Syngenta Participations AG (CH) 2011-06-15 EP disclosed
WO-2010020522-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2010-02-25 WO disclosed
WO-2010020522-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2010-02-25 WO 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 (2 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-20130165485-A1 INSECTICIDAL COMPOUNDS CHRM1, CHRM2, CHRM5 FABP4 4748/4885HSP90AA1 2272/4885FABP3 4506/4885
US-20110269804-A1 INSECTICIDAL COMPOUNDS CHRM1, CHRM2, C1R FABP4 4694/4885HSP90AA1 2337/4885FABP3 4395/4885

“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.