SCHEMBL13192446

SCHEMBL13192446

O=Cc1cccc(-c2ccc(-c3cn(C(=O)N4CCCCC4Cc4ccccc4)nn3)cc2)c1

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ DAGLA Q9Y4D2 13/20 0.81
▸ ABHD6 Q9BV23 4/20 0.81
▸ DAGLB Q8NCG7 10/20 0.73

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
SCHEMBL13192827 0.90 DAGLA (1.00) DAGLAABHD6DAGLB
SCHEMBL30095999 0.88 DAGLA (0.84) DAGLAABHD6DAGLB
SCHEMBL15426548 0.88 DAGLA (0.84) DAGLAABHD6DAGLB
SCHEMBL15427259 0.88 DAGLA (0.84) DAGLAABHD6DAGLB
SCHEMBL18936598 0.84 DAGLA (0.92) DAGLAABHD6DAGLB
SCHEMBL20575830 0.84 DAGLA (1.00) DAGLAABHD6DAGLB
SCHEMBL20575923 0.84 DAGLA (1.00) DAGLAABHD6DAGLB
SCHEMBL13192823 0.83 DAGLA (0.86) DAGLAABHD6DAGLB
SCHEMBL15426552 0.83 DAGLA (0.86) DAGLAABHD6DAGLB
SCHEMBL15426537 0.83 DAGLA (0.75) DAGLAABHD6DAGLB

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-2012138877-A1 N1- AND N2-CARBAMOYL-1,2,3-TRIAZOLE SERINE HYDROLASE INHIBITORS AND METHODS THE SCRIPPS RESEARCH INSTITUTE (US) 2012-10-11 — — WO disclosed
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