SCHEMBL20340740

SCHEMBL20340740

CCCNC(=O)CCCCCNC(=O)CCSSC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.47
EPHX2 P34913 3/20 0.47
FAAH O00519 4/20 0.46
NAAA Q02083 1/20 0.45
DNM1 Q05193 2/20 0.44
KDM4E B2RXH2 1/20 0.44
SLC6A5 Q9Y345 2/20 0.43
CNR1 P21554 2/20 0.42
EPHX1 P07099 1/20 0.41

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
SCHEMBL19084471 0.87 CASP2 (0.41) CASP2EPHX2FAAHNAAADNM1
SCHEMBL12248329 0.85 CASP2 (0.40) CASP2EPHX2FAAHNAAADNM1
SCHEMBL15298766 0.78 LMNA (0.47) CASP2EPHX2FAAHNAAADNM1
SCHEMBL31506418 0.78 CNR1 (0.42) FAAHCNR1
SCHEMBL10051008 0.78 CASP2 (0.57) CASP2EPHX2FAAHNAAADNM1
SCHEMBL9502450 0.77 CASP2 (0.71) CASP2EPHX2FAAHNAAADNM1
SCHEMBL1146790 0.77 CASP2 (0.71) CASP2EPHX2FAAHNAAADNM1
SCHEMBL9518701 0.77 CASP2 (0.71) CASP2EPHX2FAAHNAAADNM1
SCHEMBL13924359 0.77 CASP2 (0.77) CASP2EPHX2FAAHNAAADNM1
SCHEMBL6536908 0.77 LMNA (0.54) CASP2FAAHNAAADNM1CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10010562-B2 Dual molecular delivery of oligonucleotides and peptide containing conjugates MERCK SHARP & DOHME CORP. (US) 2018-07-03 US 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-10010562-B2 Dual molecular delivery of oligonucleotides and peptide containing conjugates DCLRE1A, DCLRE1B, LNPEP CASP2 3603/4885EPHX2 2055/4885FAAH 4290/4885

“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.