SCHEMBL23678310

SCHEMBL23678310

N=COC(=N)CC(O)c1cc(-c2ccc(C(F)(F)F)cc2)ccc1F

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 3/20 0.36
▸ HDAC4 P56524 1/20 0.35
▸ KIF11 P52732 5/20 0.34
▸ CTSA P10619 1/20 0.33
▸ SCN9A Q15858 5/20 0.33
▸ AGXT P21549 1/20 0.33
▸ KCNH2 Q12809 2/20 0.32
▸ TRPV3 Q8NET8 1/20 0.32
▸ MAOB P27338 1/20 0.31

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
SCHEMBL23678325 0.87 CTSA (0.36) PDE2AKIF11CTSASCN9AAGXT
SCHEMBL23678305 0.87 PDE2A (0.35) PDE2AKIF11CTSASCN9AAGXT
SCHEMBL23678485 0.85 CTSA (0.46) KIF11CTSA
SCHEMBL23678397 0.83 PDE2A (0.42) PDE2AHDAC4KIF11CTSAAGXT
SCHEMBL23678227 0.81 FFAR1 (0.41) HDAC4KIF11SCN9AAGXT
SCHEMBL23678356 0.74 ADRA2A (0.30) —
SCHEMBL23678369 0.74 — —
SCHEMBL23678196 0.74 MAOB (0.38) PDE2AKCNH2MAOB
SCHEMBL23678463 0.71 CTSA (0.37) PDE2AKIF11CTSAAGXT
SCHEMBL23678378 0.71 PDE2A (0.37) PDE2AKIF11CTSAAGXTKCNH2

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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