SCHEMBL23678329

SCHEMBL23678329

N=COC(=N)CC(OC(N)=O)c1cc(OCCCC(F)(F)F)ccc1F

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 3/20 0.36
▸ FFAR1 O14842 1/20 0.32
▸ FFAR4 Q5NUL3 1/20 0.32
▸ SCN8A Q9UQD0 1/20 0.31
▸ SCN10A Q9Y5Y9 1/20 0.31
▸ KCNH2 Q12809 2/20 0.31
▸ CACNA1B Q00975 1/20 0.31
▸ MGAT2 Q10469 1/20 0.30

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
SCHEMBL23678480 0.86 MAOB (0.36) MAOBFFAR1FFAR4KCNH2CACNA1B
SCHEMBL23678196 0.83 MAOB (0.38) MAOBSCN8ASCN10AKCNH2CACNA1B
SCHEMBL23678416 0.76 MAOB (0.35) MAOBFFAR1FFAR4KCNH2CACNA1B
SCHEMBL23678482 0.76 FFAR1 (0.38) FFAR1FFAR4
SCHEMBL23678389 0.75 CYP2C9 (0.36) FFAR1
SCHEMBL21834243 0.74 MAOB (0.35) MAOBFFAR1FFAR4
SCHEMBL23678379 0.73 KDM4E (0.38) MAOBFFAR1FFAR4
SCHEMBL21834262 0.73 MAOB (0.39) MAOBFFAR1FFAR4KCNH2CACNA1B
SCHEMBL23678335 0.72 KLKB1 (0.31) —
SCHEMBL23678483 0.71 KLKB1 (0.30) —

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
EP-3854788-A1 COMPOUND CONTAINING OXADIAZOLE, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME SK Biopharmaceuticals Co., Ltd. (KR) 2021-07-28 — — EP disclosed
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