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SCHEMBL25952586

SCHEMBL25952586

O=c1cc(-c2cnc(Oc3ccc(S(F)(F)(F)(F)F)cc3)c(-c3ccc4c(=O)ccn(CCCO)c4c3)c2)[nH]c2cc(-c3cccnc3Oc3ccc(S(F)(F)(F)(F)F)cc3)ccc12

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 13/20 0.34
▸ FEN1 P39748 1/20 0.32
▸ DRD1 P21728 1/20 0.31
▸ PDE4A P27815 1/20 0.31
▸ PDE4B Q07343 1/20 0.31
▸ LTA4H P09960 1/20 0.31
▸ KCNH2 Q12809 1/20 0.31
▸ PRKCB P05771 1/20 0.31
▸ PRKCA P17252 1/20 0.31
▸ GSK3B P49841 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ KMT2A Q03164 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
SCHEMBL25428812 0.88 PDE10A (0.38) PDE10AFEN1
SCHEMBL30544047 0.78 SCN9A (0.42) PDE10AKCNH2PRKCBGSK3B
SCHEMBL25428450 0.78 SCN9A (0.42) PDE10AKCNH2PRKCBGSK3B
SCHEMBL25430936 0.73 GSK3B (0.35) PDE10APRKCBPRKCAGSK3B
SCHEMBL25374074 0.71 PDE10A (0.44) PDE10APRKCBGSK3B
SCHEMBL25430881 0.71 PDE10A (0.42) PDE10AFEN1DRD1
SCHEMBL25430296 0.67 PDE10A (0.41) PDE10AFEN1
SCHEMBL25433941 0.67 PDE10A (0.35) PDE10AGSK3B
SCHEMBL25427800 0.66 SCN9A (0.39) PDE10AFEN1KCNH2
SCHEMBL30544057 0.66 SCN9A (0.44) —

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
WO-2023146511-A1 COMPOUNDS AND METHODS OF USE THEREOF VIVACE THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
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