SCHEMBL29364047

SCHEMBL29364047

CC(C)(C)OC(=O)N1CCC(Oc2ccc(-c3c[nH]c4c(C#N)cccc34)cc2F)C1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TBK1 Q9UHD2 9/20 0.49
▸ GPR119 Q8TDV5 4/20 0.44
▸ PIK3CD O00329 3/20 0.42
▸ PIK3CA P42336 2/20 0.42
▸ PIK3CB P42338 2/20 0.42
▸ PIK3CG P48736 2/20 0.42
▸ BRD4 O60885 1/20 0.40
▸ ALOX5AP P20292 1/20 0.39
▸ FEN1 P39748 1/20 0.39
▸ NR3C1 P04150 1/20 0.39
▸ IKBKE Q14164 1/20 0.39
▸ PDE4B Q07343 1/20 0.38

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
SCHEMBL25243805 1.00 TBK1 (0.49) TBK1GPR119PIK3CDPIK3CAPIK3CB
SCHEMBL25278423 0.81 GPR119 (0.50) TBK1GPR119PIK3CDALOX5APFEN1
SCHEMBL29364064 0.81 GPR119 (0.50) TBK1GPR119PIK3CDALOX5APFEN1
SCHEMBL25211828 0.79 PIK3CD (0.47) TBK1PIK3CD
SCHEMBL29363431 0.79 PIK3CD (0.47) TBK1PIK3CD
SCHEMBL21886989 0.77 GPR119 (0.56) GPR119PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL25215026 0.76 PIK3CD (0.43) TBK1GPR119PIK3CDPIK3CAPIK3CB
SCHEMBL29363625 0.76 PIK3CD (0.43) TBK1GPR119PIK3CDPIK3CAPIK3CB
SCHEMBL25029253 0.76 BCL9 (0.46) TBK1NR3C1
SCHEMBL30140081 0.75 GPR119 (0.47) TBK1GPR119PIK3CDPIK3CAPIK3CB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4182320-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS Nido Biosciences, Inc. (US) 2023-05-24 — — EP disclosed
WO-2022020342-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS NIDO BIOSCIENCES, INC. (US) 2022-01-27 — — WO disclosed
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