SCHEMBL3660577

SCHEMBL3660577

CCC=CCCCOc1cccc(NC)c1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.47
THRB P10828 1/20 0.43
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP2C19 P33261 1/20 0.41
FAAH O00519 2/20 0.40
EPHX2 P34913 2/20 0.39
CNR1 P21554 1/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
HSD17B10 Q99714 1/20 0.37
NR1H4 Q96RI1 2/20 0.37
PPARA Q07869 2/20 0.37
MEN1 O00255 1/20 0.36

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
SCHEMBL3660575 1.00 APP (0.47) APPTHRBCYP1A2CYP2D6MAPK1
SCHEMBL3769697 0.96 APP (0.46) APPTHRBCYP1A2CYP2D6MAPK1
SCHEMBL3658271 0.96 APP (0.46) APPTHRBCYP1A2CYP2D6MAPK1
SCHEMBL3657457 0.93 APP (0.48) APPTHRBCYP1A2CYP2D6MAPK1
SCHEMBL3657456 0.93 APP (0.48) APPTHRBCYP1A2CYP2D6MAPK1
SCHEMBL3770836 0.91 APP (0.47) APPTHRBCYP1A2CYP2D6MAPK1
SCHEMBL3661810 0.91 APP (0.47) APPTHRBCYP1A2CYP2D6MAPK1
SCHEMBL3764362 0.87 THRB (0.48) APPTHRBFAAHCNR1TSHR
SCHEMBL3658254 0.87 THRB (0.48) APPTHRBFAAHCNR1TSHR
SCHEMBL3656935 0.87 APP (0.48) APPTHRBCYP1A2CYP2D6MAPK1

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 2450/4885CYP1A2 1291/4885

“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.