SCHEMBL10286140

SCHEMBL10286140

Cc1cc2c(nc1C)C(O)CCCC2

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
UGT2B17 O75795 2/20 0.37
ACHE P22303 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
DRD2 P14416 1/20 0.32
DRD1 P21728 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HTT P42858 1/20 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
SCHEMBL10286052 0.95 UGT2B17 (0.41) UGT2B17ACHEDRD2DRD1
SCHEMBL10286132 0.83 CHRM4 (0.38) NPC1RAB9ADRD2KDM4EALDH1A1
SCHEMBL10286146 0.81 GRM1 (0.37) UGT2B17NPC1RAB9AKDM4E
SCHEMBL10286195 0.81 UGT2B17 (0.30) UGT2B17
SCHEMBL10286093 0.80 UGT2B17 (0.34) UGT2B17ACHE
SCHEMBL10286124 0.79 KDM4E (0.36) ACHENPC1RAB9AKDM4EALDH1A1
SCHEMBL10286129 0.79 NPY5R (0.32)
SCHEMBL10286048 0.79 ACHE (0.38) UGT2B17ACHEKDM4EALDH1A1
SCHEMBL10286372 0.79 UGT2B17 (0.36) UGT2B17ACHE
SCHEMBL10286292 0.79 UGT2B17 (0.36) UGT2B17ACHE

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-20130102631-A1 NOVEL MICROBIOCIDAL DIOXIME ETHER DERIVATIVES SYNGENTA CROP PROTECTION LLC (US) 2013-04-25 US disclosed
US-20130102631-A1 NOVEL MICROBIOCIDAL DIOXIME ETHER DERIVATIVES SYNGENTA CROP PROTECTION LLC (US) 2013-04-25 US disclosed
WO-2012001040-A1 NOVEL MICROBIOCIDAL DIOXIME ETHER DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2012-01-05 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-20130102631-A1 NOVEL MICROBIOCIDAL DIOXIME ETHER DERIVATIVES MSR1, DDT, MPO UGT2B17 1446/4885ACHE 660/4885NPC1 3975/4885

“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.