SCHEMBL5685684

SCHEMBL5685684

CC#CCOc1ccc(CCC(=O)OCC)cc1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.47
CYP4F2 P78329 1/20 0.47
CYP4A11 Q02928 1/20 0.47
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HDAC1 Q13547 1/20 0.44
HDAC2 Q92769 1/20 0.44
DRD2 P14416 1/20 0.44
ALDH1A1 P00352 2/20 0.44
KMT2A Q03164 1/20 0.43
CALM1 P0DP23 2/20 0.43
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA9 Q16790 2/20 0.43
PDE4B Q07343 1/20 0.43
KDM4E B2RXH2 1/20 0.42
CHRM5 P08912 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42

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
SCHEMBL5958023 0.87 APP (0.48) APPCYP4F2CYP4A11LMNASMN1; SMN2
SCHEMBL5685284 0.86 CALM1 (0.57) APPCYP4F2CYP4A11LMNASMN1; SMN2
SCHEMBL5685544 0.85 FFAR4 (0.51) APPSMN1; SMN2ALDH1A1KMT2A
SCHEMBL491276 0.85 CYP4F2 (0.59) CYP4F2CYP4A11LMNASMN1; SMN2DRD2
SCHEMBL5688330 0.83 HDAC1 (0.56) APPCYP4F2CYP4A11LMNASMN1; SMN2
SCHEMBL5688352 0.82 CYP4F2 (0.48) APPCYP4F2CYP4A11LMNASMN1; SMN2
SCHEMBL5685578 0.81 CYP4F2 (0.54) APPCYP4F2CYP4A11LMNASMN1; SMN2
SCHEMBL5685688 0.80 CYP4F2 (0.51) APPCYP4F2CYP4A11LMNAKMT2A
SCHEMBL5688130 0.80 LTA4H (0.60) APPCYP4F2CYP4A11LMNASMN1; SMN2
SCHEMBL5881099 0.80 APP (0.73) APPSMN1; SMN2HDAC1HDAC2KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060122064-A1 Amides and method for plant diseases control with the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-06-08 US disclosed
EP-1640360-A1 AMIDES AND METHOD FOR PLANT DISEASE CONTROL WITH THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-03-29 EP 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-20060122064-A1 Amides and method for plant diseases control with the same ARG1, ARGLU1, ARG2 APP 3090/4885CYP4F2 2186/4885CYP4A11 1192/4885

“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.