SCHEMBL10299548

SCHEMBL10299548

CCCCCCCCCCCCCCOCCCNC(=O)OCCC

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.71
EPHX1 P07099 2/20 0.55
EPHX2 P34913 2/20 0.54

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
SCHEMBL10599960 0.95 ACHE (0.79) ACHEEPHX1EPHX2
SCHEMBL10789983 0.95 ACHE (0.79) ACHEEPHX1EPHX2
SCHEMBL11047247 0.89 ACHE (0.75) ACHEEPHX1EPHX2
SCHEMBL7685648 0.89 ACHE (0.75) ACHEEPHX1EPHX2
SCHEMBL13700187 0.88 ACHE (0.73) ACHEEPHX1EPHX2
SCHEMBL19107899 0.87 ACHE (0.68) ACHEEPHX1EPHX2
SCHEMBL10299296 0.87 ACHE (0.63) ACHEEPHX1EPHX2
SCHEMBL19107903 0.87 ACHE (0.68) ACHEEPHX1EPHX2
SCHEMBL7687969 0.87 ACHE (0.77) ACHEEPHX1EPHX2
SCHEMBL30080535 0.86 ACHE (0.71) ACHEEPHX1EPHX2

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-20120172411-A1 NOVEL TRIALKYL CATIONIC LIPIDS AND METHODS OF USE THEREOF PROTIVA BIOTHERAPEUTICS, INC. (CA) 2012-07-05 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-20120172411-A1 NOVEL TRIALKYL CATIONIC LIPIDS AND METHODS OF USE THEREOF NPC1L1, LDLR, CETP ACHE 4843/4885EPHX1 3974/4885EPHX2 3656/4885

“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.