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SCHEMBL18935809

SCHEMBL18935809

CC(C)(C)OC(=O)N1CCN(C(=O)n2ncc(-c3ccc(OC(F)(F)F)cc3)n2)[C@H](Cc2ccccc2)C1

nearest known ligand 0.75

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DAGLA Q9Y4D2 13/20 0.75
▸ ABHD6 Q9BV23 3/20 0.75
▸ DAGLB Q8NCG7 7/20 0.50
▸ DDHD2 O94830 1/20 0.48
▸ PARP1 P09874 1/20 0.41
▸ GPR119 Q8TDV5 1/20 0.41
▸ DPP4 P27487 1/20 0.40
▸ NR1H2 P55055 1/20 0.40
▸ NR1H3 Q13133 1/20 0.40

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
SCHEMBL18935799 1.00 DAGLA (0.75) DAGLAABHD6DAGLBDDHD2PARP1
SCHEMBL18935802 1.00 DAGLA (0.75) DAGLAABHD6DAGLBDDHD2PARP1
SCHEMBL20576205 0.92 DAGLA (0.63) DAGLAABHD6DAGLBDDHD2
SCHEMBL20575956 0.90 DAGLA (0.60) DAGLAABHD6DAGLBDDHD2
SCHEMBL20575954 0.90 DAGLA (0.60) DAGLAABHD6DAGLBDDHD2
SCHEMBL20576014 0.90 DAGLA (0.60) DAGLAABHD6DAGLBDDHD2
SCHEMBL18935645 0.90 DAGLA (0.61) DAGLAABHD6DAGLBDDHD2
SCHEMBL18921254 0.88 DAGLA (0.58) DAGLAABHD6DAGLBDDHD2
SCHEMBL18921279 0.86 ABHD6 (0.74) DAGLAABHD6DAGLBDDHD2GPR119
SCHEMBL18936194 0.86 DAGLA (1.00) 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-2017096315-A1 TRIAZOLE DAGL(α) INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2017-06-08 — — WO disclosed