SCHEMBL3663859

SCHEMBL3663859

CCC#CCOc1cccc(NC)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.50
MTNR1A P48039 1/20 0.43
HSD17B10 Q99714 2/20 0.40
HTT P42858 1/20 0.40
CYP1A2 P05177 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GRM5 P41594 4/20 0.38
THRB P10828 1/20 0.37
KCNH2 Q12809 1/20 0.36
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SYK P43405 1/20 0.35

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
SCHEMBL3661658 0.88 APP (0.48) APPMTNR1AHSD17B10HTTGRM5
SCHEMBL3659653 0.85 APP (0.51) APPHSD17B10HTTGRM5KCNH2
SCHEMBL3657413 0.85 APP (0.46) APPHSD17B10HTTGRM5THRB
SCHEMBL3661397 0.84 APP (0.48) APPHSD17B10HTTCYP1A2THRB
SCHEMBL3656315 0.84 APP (0.45) APPHSD17B10HTTTHRBKCNH2
SCHEMBL3658934 0.83 APP (0.47) APPHSD17B10HTTCYP1A2THRB
SCHEMBL3662533 0.82 APP (0.46) APPHSD17B10HTTCYP1A2KDM4E
SCHEMBL2854896 0.81 RAB9A (0.58) MTNR1AHSD17B10HTTALDH1A1MEN1
SCHEMBL3661921 0.80 APP (0.53) APPMTNR1ATP53MAPTGMPS
SCHEMBL8306841 0.79 APP (0.58) APPHSD17B10HTTCYP1A2ALDH1A1

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-20100311790-A1 AMIDE COMPOUNDS AND PLANT DISEASE CONTROLLING METHOD USING SAME SUMITOMO CHIEMCAL COMPANY LIMITED (JP) 2010-12-09 US disclosed
EP-2215062-A1 AMIDE COMPOUNDS AND PLANT DISEASE CONTROLLING METHOD USING SAME Sumitomo Chemical Company, Limited (JP) 2010-08-11 EP disclosed
WO-2009069792-A1 AMIDE COMPOUNDS AND PLANT DISEASE CONTROLLING METHOD USING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-06-04 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-20100311790-A1 AMIDE COMPOUNDS AND PLANT DISEASE CONTROLLING METHOD USING SAME ATL3, NAT1, C5 APP 2380/4885MTNR1A 1607/4885HSD17B10 754/4885

“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.