SCHEMBL1833528

SCHEMBL1833528

Cc1cc(-n2c(C(F)(F)C(F)(F)F)nnc2C(F)(F)C(F)(F)F)ccc1N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.53
MAPT P10636 6/20 0.53
RAD52 P43351 2/20 0.53
THRB P10828 1/20 0.44
MEN1 O00255 7/20 0.39
KMT2A Q03164 7/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GAA P10253 5/20 0.38
ALDH1A1 P00352 7/20 0.36
CYP3A4 P08684 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
TSHR P16473 1/20 0.36
NPC1 O15118 4/20 0.35
RAB9A P51151 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.33
HPGD P15428 1/20 0.33
MCL1 Q07820 1/20 0.33
S100B P04271 1/20 0.33
LMNA P02545 1/20 0.32
ATM Q13315 1/20 0.32

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
SCHEMBL1834634 0.87 KDM4E (0.55) KDM4EMAPTRAD52THRBMEN1
SCHEMBL1827389 0.76 HPGD (0.48) KDM4EMAPTMEN1KMT2ANPSR1
SCHEMBL2892036 0.75 SKP2 (0.40) KDM4EMAPTRAD52MEN1KMT2A
SCHEMBL2884387 0.72 MAPT (0.39) KDM4EMAPTRAD52THRBMEN1
SCHEMBL2887965 0.72 KDM4E (0.39) KDM4EMAPTRAD52THRBMEN1
SCHEMBL2889321 0.71 RAD52 (0.38) KDM4EMAPTRAD52THRBMEN1
SCHEMBL3377615 0.70 CYP3A4 (0.48) KDM4EMAPTRAD52THRBGAA
SCHEMBL2889812 0.70 KDM4E (0.42) KDM4EMAPTRAD52THRBMEN1
SCHEMBL1834850 0.66 KDM4E (0.39) KDM4EMAPTRAD52THRBMEN1
SCHEMBL2892005 0.65 STIM1 (0.44) KDM4EMAPTRAD52THRBALDH1A1

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 KDM4E 346/4885MAPT 4079/4885RAD52 2466/4885

“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.