SCHEMBL16610350

SCHEMBL16610350

CN(C)c1ccc(-c2ccc3c4cnccc4n(C(=O)OC(C)(C)C)c3c2)cn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 6/20 0.46
▸ NPC1 O15118 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ MAPT P10636 1/20 0.40
▸ GABRG2 P18507 2/20 0.39
▸ GABRB3 P28472 2/20 0.39
▸ GABRA5 P31644 2/20 0.39
▸ GABRA1 P14867 1/20 0.37
▸ GABRA2 P47869 1/20 0.37
▸ GABRA6 Q16445 1/20 0.37
▸ PIK3CD O00329 1/20 0.37
▸ MAP3K11 Q16584 1/20 0.35
▸ TTK P33981 1/20 0.34
▸ AOC3 Q16853 1/20 0.34
▸ PSEN1 P49768 1/20 0.34
▸ PSEN2 P49810 1/20 0.34
▸ APH1B Q8WW43 1/20 0.34

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
SCHEMBL18012185 0.87 GABRG2 (0.41) GPR119MAPTGABRG2GABRB3GABRA5
SCHEMBL16610290 0.84 GABRG2 (0.39) GPR119GABRG2GABRB3GABRA5GABRA1
SCHEMBL16268180 0.82 GABRG2 (0.38) GPR119MAPTGABRG2GABRB3GABRA5
SCHEMBL20129203 0.82 NR1H2 (0.41) GPR119GABRG2GABRB3GABRA5GABRA1
SCHEMBL20133366 0.79 GPR119 (0.42) GPR119GABRG2GABRB3GABRA5PIK3CD
SCHEMBL29547275 0.79 GPR119 (0.38) GPR119GABRG2GABRB3GABRA5GABRA1
SCHEMBL29773812 0.79 NR1H2 (0.38) GPR119GABRG2GABRB3GABRA5GABRA1
SCHEMBL20120812 0.79 NR1H2 (0.38) GPR119GABRG2GABRB3GABRA5GABRA1
SCHEMBL31411068 0.79 GPR119 (0.38) GPR119GABRG2GABRB3GABRA5GABRA1
SCHEMBL29547450 0.79 NR1H2 (0.38) GPR119GABRG2GABRB3GABRA5GABRA1

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-2015047902-A1 COMPOUNDS AND THEIR USE FOR PREPARATION OF TAU IMAGING AGENTS AND TAU IMAGING FORMULATIONS ELI LILLY AND COMPANY (US) 2015-04-02 — — WO disclosed
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