SCHEMBL10286364

SCHEMBL10286364

OC1CCCCc2c(-c3ccc(F)cc3)cc(Cl)nc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.41
HTR2A P28223 5/20 0.41
ACHE P22303 1/20 0.38
KDM4E B2RXH2 3/20 0.36
MAPT P10636 1/20 0.36
HRH2 P25021 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
CYP11B2 P19099 3/20 0.36
CYP11B1 P15538 2/20 0.35
ALDH1A1 P00352 2/20 0.34
AXL P30530 1/20 0.34
FLT3 P36888 1/20 0.34
TYRO3 Q06418 1/20 0.34
MERTK Q12866 1/20 0.34
NPC1 O15118 1/20 0.34
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL10287317 0.96 DRD2 (0.43) DRD2HTR2AACHEKDM4EMAPT
SCHEMBL10286310 0.85 GRM2 (0.39) GRM2CNR1
SCHEMBL10286804 0.79 GRM2 (0.38) DRD2HTR2AKDM4EHRH2HRH3
SCHEMBL7332801 0.76 DRD2 (0.52) DRD2HTR2AACHEKDM4EMAPT
SCHEMBL9614388 0.76 DRD2 (0.70) DRD2HTR2AKDM4EMAPTALDH1A1
SCHEMBL10286075 0.76 DRD2 (0.39) DRD2HTR2AKDM4EHRH2HRH3
SCHEMBL7336033 0.75 DRD2 (0.54) DRD2HTR2AACHEKDM4EMAPT
SCHEMBL31297518 0.75 DRD2 (0.54) DRD2HTR2AACHEKDM4EMAPT
SCHEMBL10286055 0.73 HRH2 (0.41) ACHEKDM4EMAPTHRH2HRH3
SCHEMBL10287390 0.71 ACHE (0.47) ACHEKDM4EMAPTALDH1A1TP53

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 DRD2 149/4885HTR2A 3575/4885ACHE 660/4885

“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.