SCHEMBL29328381

SCHEMBL29328381

CCCCCCNC(=O)OCCOCCC(C)C

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 14/20 0.60
▸ EPHX1 P07099 1/20 0.51
▸ EPHX2 P34913 2/20 0.48

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
SCHEMBL13700220 0.89 ACHE (0.75) ACHEEPHX1EPHX2
SCHEMBL3966156 0.85 ACHE (0.70) ACHEEPHX1EPHX2
SCHEMBL11653355 0.84 ACHE (0.68) ACHEEPHX1EPHX2
SCHEMBL1837517 0.84 ACHE (0.72) ACHEEPHX1EPHX2
SCHEMBL10791633 0.84 ACHE (0.72) ACHEEPHX1EPHX2
SCHEMBL13073329 0.84 ACHE (0.72) ACHE
SCHEMBL980753 0.84 ACHE (0.56) ACHE
SCHEMBL13700167 0.84 ACHE (0.84) ACHEEPHX1EPHX2
SCHEMBL10582501 0.83 ACHE (0.70) ACHEEPHX1EPHX2
SCHEMBL11308898 0.83 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12043636-B2 Method for producing triarylorganoborates COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2024-07-23 — — 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-12043636-B2 Method for producing triarylorganoborates KMO, COASY, CYP3A4 ACHE 976/4885EPHX1 2960/4885EPHX2 1663/4885

“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.

Send feedback