SCHEMBL17425110

SCHEMBL17425110

CCCCCCCCCCCCSCCCOC(=O)NCCN(CC)CC

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.53
EPHX1 P07099 1/20 0.43
EPHX2 P34913 2/20 0.42
TLR2 O60603 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
SCHEMBL17425111 1.00 ACHE (0.53) ACHEEPHX1EPHX2TLR2
SCHEMBL17425147 0.93 ACHE (0.55) ACHEEPHX1EPHX2TLR2
SCHEMBL17425131 0.93 ACHE (0.55) ACHEEPHX1EPHX2TLR2
SCHEMBL7201630 0.91 ACHE (0.59) ACHEEPHX1EPHX2TLR2
SCHEMBL7200737 0.90 ACHE (0.54) ACHEEPHX1EPHX2TLR2
SCHEMBL17425144 0.88 ACHE (0.54) ACHEEPHX1EPHX2TLR2
SCHEMBL17425145 0.88 ACHE (0.54) ACHEEPHX1EPHX2TLR2
SCHEMBL17425148 0.84 ACHE (0.56) ACHEEPHX1EPHX2TLR2
SCHEMBL17425102 0.84 ACHE (0.56) ACHEEPHX1EPHX2TLR2
SCHEMBL7749335 0.81 ACHE (0.70) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170204076-A1 SYNTHESIS AND USE OF AMINO LIPIDS SCREENFECT GMBH (DE) 2017-07-20 US disclosed
US-20170204076-A1 SYNTHESIS AND USE OF AMINO LIPIDS SCREENFECT GMBH (DE) 2017-07-20 US disclosed
EP-2966068-A1 Synthesis and use of amino lipids Incella GmbH (DE) 2016-01-13 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-20170204076-A1 SYNTHESIS AND USE OF AMINO LIPIDS ACSL4, PYM1, LPAR4 ACHE 2986/4885EPHX1 965/4885EPHX2 581/4885

“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.