SCHEMBL1832743

SCHEMBL1832743

Nc1ccc(Cn2cc(I)c(C(F)(F)C(F)(F)F)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
MAPT P10636 1/20 0.37
KLKB1 P03952 6/20 0.34
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
RAB9A P51151 1/20 0.31
DUSP3 P51452 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ADORA3 P0DMS8 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 1/20 0.30
AADAT Q8N5Z0 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
SCHEMBL1832731 0.84 LMNA (0.38) LMNAMAPTKLKB1CYP11B1CYP11B2
SCHEMBL1836900 0.81 SKP2 (0.35) LMNAMAPTKLKB1ALDH1A1KMT2A
SCHEMBL1833544 0.74 HTR1A (0.33) KLKB1
SCHEMBL1833832 0.74 KLKB1 (0.35) LMNAKLKB1
SCHEMBL1835910 0.71
SCHEMBL21420053 0.71 HSP90AA1 (0.43) MAPTKLKB1ALDH1A1KMT2AKDM4E
SCHEMBL2161475 0.71 KLKB1 (0.39) KLKB1
SCHEMBL2810810 0.71 PTGDR2 (0.43) LMNAMAPTKLKB1ALDH1A1
SCHEMBL1834306 0.68 CA1 (0.30)
SCHEMBL6036214 0.68 HTR2C (0.39) LMNAMAPTALDH1A1RAB9ASMN1; SMN2

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 LMNA 1928/4885MAPT 4079/4885KLKB1 4858/4885

“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.