SCHEMBL18935808

SCHEMBL18935808

COc1cc(OC)c(-c2ccc(C3=CN(C(=O)N4CCCCC4Cc4ccccc4)NN3)cc2)c(OC)c1

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ DAGLB Q8NCG7 13/20 0.60
▸ DAGLA Q9Y4D2 8/20 0.54
▸ ROCK2 O75116 1/20 0.44

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
SCHEMBL18936191 0.90 DAGLA (0.67) DAGLBDAGLAROCK2
SCHEMBL18935800 0.82 DAGLA (0.50) DAGLBDAGLA
SCHEMBL18921267 0.79 DAGLB (0.88) DAGLBDAGLA
SCHEMBL20576801 0.78 DAGLB (0.67) DAGLBDAGLAROCK2
SCHEMBL18936720 0.77 DAGLB (0.66) DAGLBDAGLA
SCHEMBL20575837 0.75 DAGLB (1.00) DAGLBDAGLA
SCHEMBL18935653 0.75 DAGLB (1.00) DAGLBDAGLA
SCHEMBL20575918 0.74 DAGLB (1.00) DAGLBDAGLA
SCHEMBL18936596 0.73 DAGLB (1.00) DAGLBDAGLA
SCHEMBL20576109 0.72 DAGLB (1.00) 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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