SCHEMBL6508028

SCHEMBL6508028

O=C(OCc1ccccc1)N(CCl)CCl

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.58
CCR6 P51684 1/20 0.54
PAX8 Q06710 1/20 0.54
TDP1 Q9NUW8 3/20 0.52
KMT2A Q03164 2/20 0.52
MAPK1 P28482 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
SLC6A2 P23975 1/20 0.52
SLC6A3 Q01959 1/20 0.52
LMNA P02545 3/20 0.47
HCAR2 Q8TDS4 1/20 0.47
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
MMP12 P39900 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL2924379 0.86 CCR6 (0.58) ALDH1A1CCR6PAX8TDP1KMT2A
SCHEMBL27364470 0.83 CCR6 (0.55) ALDH1A1CCR6PAX8TDP1KMT2A
SCHEMBL17688549 0.82 ALDH1A1 (0.55) ALDH1A1CCR6PAX8TDP1KMT2A
SCHEMBL25629399 0.81 CCR6 (0.54) ALDH1A1CCR6PAX8TDP1KMT2A
SCHEMBL16665613 0.81 ALDH1A1 (0.58) ALDH1A1CCR6PAX8TDP1KMT2A
SCHEMBL801192 0.81 CCR6 (0.54) ALDH1A1CCR6PAX8TDP1KMT2A
SCHEMBL9213185 0.81 ALDH1A1 (0.62) ALDH1A1CCR6PAX8TDP1KMT2A
SCHEMBL9359355 0.81 ALDH1A1 (0.53) ALDH1A1CCR6PAX8TDP1KMT2A
SCHEMBL554069 0.80 CCR6 (0.64) ALDH1A1CCR6PAX8TDP1KMT2A
SCHEMBL15965959 0.79 CCR6 (0.51) ALDH1A1CCR6PAX8TDP1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050159599-A1 Cyclic compound, process for producing the same, and pest control agent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-07-21 US disclosed
EP-1481972-A1 CYCLIC COMPOUND, PROCESS FOR PRODUCING THE SAME, AND PEST CONTROL AGENT Sumitomo Chemical Takeda Agro Company, Limited (JP) 2004-12-01 EP 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-20050159599-A1 Cyclic compound, process for producing the same, and pest control agent CNPY2, CNPY3, HAX1 ALDH1A1 3437/4885CCR6 3258/4885PAX8 4327/4885

“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.