SCHEMBL28666815

SCHEMBL28666815

COc1ccc(OC2CCN(C(=O)OC(C)(C)C)C2)cn1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 6/20 0.52
▸ PIK3CD O00329 7/20 0.50
▸ PIK3CA P42336 7/20 0.50
▸ PIK3CB P42338 3/20 0.50
▸ PIK3CG P48736 3/20 0.50
▸ USP30 Q70CQ3 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.47

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
SCHEMBL28666814 1.00 GPR119 (0.52) GPR119PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19023504 0.93 GPR119 (0.59) GPR119PIK3CDALDH1A1
SCHEMBL29419894 0.93 GPR119 (0.59) GPR119PIK3CDALDH1A1
SCHEMBL31470957 0.91 GPR119 (0.48) GPR119PIK3CDPIK3CAUSP30ALDH1A1
SCHEMBL28638431 0.91 GPR119 (0.48) GPR119PIK3CDPIK3CAUSP30ALDH1A1
SCHEMBL28427023 0.88 USP30 (0.52) GPR119PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL31044606 0.88 USP30 (0.52) GPR119PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL28418675 0.88 USP30 (0.52) GPR119PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL31044644 0.88 USP30 (0.52) GPR119PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL28418678 0.88 USP30 (0.52) GPR119PIK3CDPIK3CAPIK3CBPIK3CG

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
CN-110177786-B Substituted pyrazolo [1,5-A ] pyridine compounds as RET kinase inhibitors 阿雷生物药品公司 2021-12-14 — — CN disclosed
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