SCHEMBL1833430

SCHEMBL1833430

Cc1nc(Cn2nc(C(F)(F)F)cc2C(F)(F)C(F)(F)F)ccc1N

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GRIA2 P42262 2/20 0.34
GRIN1 Q05586 9/20 0.33
GRIN2A Q12879 9/20 0.33
ADORA2A P29274 1/20 0.33
HDAC3 O15379 1/20 0.32
HDAC4 P56524 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC7 Q8WUI4 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC10 Q969S8 1/20 0.32
HDAC11 Q96DB2 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC9 Q9UKV0 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32
NCOR2 Q9Y618 1/20 0.32
PRMT6 Q96LA8 1/20 0.32
TLR7 Q9NYK1 3/20 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
SCHEMBL1833416 0.94
SCHEMBL1186949 0.91 GRIA2 (0.40) L3MBTL1KDM4EGRIA2GRIN1GRIN2A
SCHEMBL1836556 0.90 GRIA2 (0.34) L3MBTL1KDM4EGRIA2GRIN1GRIN2A
SCHEMBL2161167 0.86 GRIA2 (0.33) L3MBTL1KDM4EGRIA2GRIN1GRIN2A
SCHEMBL1186376 0.85 HPGD (0.42) L3MBTL1KDM4EGRIN1GRIN2AALDH1A1
SCHEMBL2161378 0.77 GRIN2A (0.40) L3MBTL1KDM4EGRIA2GRIN1GRIN2A
SCHEMBL1834825 0.77
SCHEMBL1834822 0.75
SCHEMBL1836181 0.74 GAA (0.32) ALDH1A1
SCHEMBL2889650 0.72 SKP2 (0.36) KDM4EGRIA2ADORA2AHDAC3HDAC4

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
US-20110184188-A1 Insecticidal Benzenedicarboxamide Derivative BAYER CROPSCIENCE AG (DE) 2011-07-28 US disclosed
EP-2318374-A2 INSECTICIDAL BENZENEDICARBOXAMIDE DERIVATIVE Bayer CropScience AG (DE) 2011-05-11 EP disclosed
WO-2010012442-A2 INSECTICIDAL BENZENEDICARBOXAMIDE DERIVATIVE BAYER CROPSCIENCE AG (DE) 2010-02-04 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-20110184188-A1 Insecticidal Benzenedicarboxamide Derivative DDT, BRD9, BCL2A1 L3MBTL1 217/4885KDM4E 346/4885GRIA2 3485/4885

“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.