SCHEMBL3657413

SCHEMBL3657413

CCCCC#CCOc1cccc(NC)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.46
THRB P10828 1/20 0.42
FAAH O00519 1/20 0.39
TSHR P16473 1/20 0.37
KMT2A Q03164 1/20 0.37
HTT P42858 1/20 0.36
HSD17B10 Q99714 1/20 0.36
NR1H4 Q96RI1 2/20 0.36
MMP9 P14780 1/20 0.36
MMP13 P45452 1/20 0.36
ADAM17 P78536 1/20 0.36
SMPD1 P17405 3/20 0.35
GRM5 P41594 2/20 0.35
KCNH2 Q12809 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
SCHEMBL3656315 0.96 APP (0.45) APPTHRBFAAHTSHRKMT2A
SCHEMBL3661658 0.91 APP (0.48) APPTHRBFAAHKMT2AHTT
SCHEMBL3658408 0.89 THRB (0.48) APPTHRBFAAHTSHRKMT2A
SCHEMBL3663859 0.85 APP (0.50) APPTHRBKMT2AHTTHSD17B10
SCHEMBL3659980 0.84 APP (0.47) APPTHRBFAAHTSHRKMT2A
SCHEMBL3658934 0.81 APP (0.47) APPTHRBFAAHTSHRKMT2A
SCHEMBL3659653 0.80 APP (0.51) APPKMT2AHTTHSD17B10MMP9
SCHEMBL3662533 0.80 APP (0.46) APPTHRBFAAHTSHRKMT2A
SCHEMBL13169873 0.80 THRB (0.60) APPTHRBFAAHTSHRKMT2A
SCHEMBL3655639 0.79 APP (0.48) APPTHRBFAAHTSHRKMT2A

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 2380/4885THRB 2450/4885FAAH 19/4885

“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.