SCHEMBL10286376

SCHEMBL10286376

OC1CCCc2ccc(Oc3ccccc3)nc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.41
ALDH1A1 P00352 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
TSHR P16473 1/20 0.35
NR3C1 P04150 1/20 0.35
KCNH2 Q12809 1/20 0.35
F2 P00734 3/20 0.35
F10 P00742 3/20 0.35
PRSS1 P07477 1/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35
ST14 Q9Y5Y6 1/20 0.35
HRH3 Q9Y5N1 2/20 0.35
BCAT2 O15382 1/20 0.34
HAO1 Q9UJM8 1/20 0.34
GRM5 P41594 3/20 0.34
MAP4K4 O95819 1/20 0.34
HTT P42858 1/20 0.33
HDAC8 Q9BY41 1/20 0.33

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
SCHEMBL10286321 0.79 HTR2C (0.39) ACHE
SCHEMBL10286365 0.77 ACHE (0.47) ACHEALDH1A1CYP1A2CYP2C9TSHR
SCHEMBL10286304 0.76 ACHE (0.49) ACHEALDH1A1CYP1A2CYP2C9TSHR
SCHEMBL10286338 0.75 POLB (0.34) ACHEALDH1A1KCNH2HDAC8
SCHEMBL10287024 0.75 ACHE (0.43) ACHEALDH1A1CYP1A2CYP2C9TSHR
SCHEMBL14884989 0.75 ACHE (0.43) ACHEALDH1A1CYP1A2CYP2C9TSHR
SCHEMBL3311055 0.75 ACHE (0.43) ACHEALDH1A1CYP1A2CYP2C9TSHR
SCHEMBL10286327 0.72 ACHE (0.39) ACHEALDH1A1CYP1A2CYP2C9TSHR
SCHEMBL31598496 0.71 RAB9A (0.40) ACHEALDH1A1CYP1A2CYP2C9TSHR
SCHEMBL10286368 0.71 RAB9A (0.40) ACHEALDH1A1CYP1A2CYP2C9TSHR

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 ACHE 660/4885ALDH1A1 1110/4885CYP1A2 69/4885

“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.