SCHEMBL926161

SCHEMBL926161

CC(=O)NCc1ccc(C2=NCC(c3cc(Cl)cc(Cl)c3)(C(F)(F)F)C2)c2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 4/20 0.39
L3MBTL1 Q9Y468 1/20 0.35
EPHX2 P34913 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
MAPT P10636 1/20 0.33
ORAI1 Q96D31 3/20 0.33
F2 P00734 1/20 0.33
KCNJ6 P48051 1/20 0.33
KCNJ5 P48544 1/20 0.33
KCNJ3 P48549 1/20 0.33
SETDB1 Q15047 1/20 0.32
DGAT2 Q96PD7 1/20 0.31
CYP11B2 P19099 1/20 0.31
NQO2 P16083 1/20 0.30

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
SCHEMBL12905164 0.85 PDK2 (0.31) PDK2ORAI1KCNJ6KCNJ5KCNJ3
SCHEMBL925878 0.85 PDK2 (0.39) PDK2ORAI1KCNJ6KCNJ5KCNJ3
SCHEMBL926057 0.82 EPHX2 (0.35) PDK2L3MBTL1EPHX2NR1H4MAPT
SCHEMBL926116 0.82 PDK2 (0.32) PDK2
SCHEMBL935733 0.81 PDK2 (0.38) PDK2MAPT
SCHEMBL926150 0.79 EPHX2 (0.30) EPHX2NR1H4
SCHEMBL18397726 0.78 CYP1A2 (0.35) EPHX2NR1H4CYP11B2
SCHEMBL925663 0.77 EPHX2 (0.31) PDK2EPHX2NR1H4ORAI1
SCHEMBL28802064 0.75 MCHR1 (0.35) EPHX2NR1H4MAPT
SCHEMBL27898930 0.75 KDM4E (0.38) L3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2242739-B1 INSECTICIDAL ARYLPYRROLINES BAYER CROPSCIENCE AG (DE) 2014-11-12 EP disclosed
EP-2242739-B1 INSECTICIDAL ARYLPYRROLINES BAYER CROPSCIENCE AG (DE) 2014-11-12 EP disclosed
US-8304371-B2 Insecticidal arylpyrrolines BAYER CROPSCIENCE AG (DE) 2012-11-06 US disclosed
US-8304371-B2 Insecticidal arylpyrrolines BAYER CROPSCIENCE AG (DE) 2012-11-06 US disclosed
US-20110003690-A1 INSECTICIDAL ARYLPYRROLINES BAY CROPSCIENCE AG (DE) 2011-01-06 US disclosed
US-20110003690-A1 INSECTICIDAL ARYLPYRROLINES BAY CROPSCIENCE AG (DE) 2011-01-06 US disclosed
WO-2009097992-A1 INSECTICIDAL ARYLPYRROLINES BAYER CROPSCIENCE AG (DE) 2009-08-13 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 (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-20110003690-A1 INSECTICIDAL ARYLPYRROLINES DDT, ACHE, CYP1A2 PDK2 1748/4885L3MBTL1 1028/4885EPHX2 392/4885

“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.