SCHEMBL30010462

SCHEMBL30010462

CCCCOC(=O)NC/C=C\CCl

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 14/20 0.50
▸ HRH4 Q9H3N8 1/20 0.48
▸ HRH3 Q9Y5N1 1/20 0.48
▸ EPHX1 P07099 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ EPHX2 P34913 1/20 0.43

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
SCHEMBL23857527 0.88 HRH4 (0.39) ACHEHRH4HRH3EPHX1ATM
SCHEMBL22121365 0.83 ACHE (0.50) ACHEHRH4HRH3EPHX1
SCHEMBL22121364 0.83 ACHE (0.50) ACHEHRH4HRH3EPHX1
SCHEMBL31113456 0.83 ACHE (0.50) ACHEHRH4HRH3EPHX1ATM
SCHEMBL4921718 0.83 ACHE (0.53) ACHEEPHX1ATMEPHX2
SCHEMBL12393903 0.82 HRH4 (0.50) ACHEHRH4HRH3EPHX2
SCHEMBL345235 0.79 ACHE (0.56) ACHEEPHX1ATM
SCHEMBL7206365 0.78 ACHE (0.60) ACHEEPHX1ATM
SCHEMBL1486852 0.77 ACHE (0.55) ACHEEPHX1ATM
SCHEMBL28178050 0.75 ACHE (0.67) ACHEEPHX1

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
EP-4341272-A1 METHOD FOR PREPARING A LIBRARY OF PEPTIDES OR A PEPTIDE ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2024-03-27 — — EP disclosed
WO-2022242993-A1 METHOD FOR PREPARING A LIBRARY OF PEPTIDES OR A PEPTIDE ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2022-11-24 — — WO disclosed
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