SCHEMBL18935653

SCHEMBL18935653

COc1cc(OC)c(-c2cnn(C(=O)N3CCCCC3Cc3ccccc3)n2)c(OC)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ DAGLB Q8NCG7 8/20 1.00
▸ DAGLA Q9Y4D2 12/20 0.72
▸ ABHD6 Q9BV23 6/20 0.57

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
SCHEMBL18936599 0.84 DAGLA (1.00) DAGLBDAGLAABHD6
SCHEMBL20575837 0.84 DAGLB (1.00) DAGLBDAGLAABHD6
SCHEMBL20575918 0.81 DAGLB (1.00) DAGLBDAGLAABHD6
SCHEMBL20576801 0.80 DAGLB (0.67) DAGLBDAGLA
SCHEMBL18921267 0.79 DAGLB (0.88) DAGLBDAGLAABHD6
SCHEMBL13192448 0.77 DAGLA (0.71) DAGLBDAGLAABHD6
SCHEMBL18936205 0.76 DAGLA (0.67) DAGLBDAGLAABHD6
SCHEMBL18936213 0.76 DAGLA (0.67) DAGLBDAGLAABHD6
SCHEMBL18936215 0.76 DAGLA (0.67) DAGLBDAGLAABHD6
SCHEMBL18935808 0.75 DAGLB (0.60) DAGLBDAGLA

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-2017096315-A1 TRIAZOLE DAGL(α) INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2017-06-08 — — WO disclosed
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