SCHEMBL30127016

SCHEMBL30127016

CC(C)(C)OC(=O)N1CC2CCN(c3ccc4ncnc(Cl)c4c3)C2C1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 1/20 0.45
▸ PIK3CD O00329 3/20 0.42
▸ PIK3CA P42336 2/20 0.42
▸ PIK3CB P42338 2/20 0.42
▸ PIK3CG P48736 2/20 0.42
▸ GPR119 Q8TDV5 12/20 0.42
▸ IRAK4 Q9NWZ3 1/20 0.40
▸ LIPE Q05469 2/20 0.40
▸ JAK1 P23458 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
SCHEMBL30125919 0.90 GPR119 (0.43) USP30PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL30126118 0.84 PIK3CD (0.39) PIK3CDPIK3CAPIK3CBPIK3CGGPR119
SCHEMBL30125930 0.82 EGFR (0.49) USP30
SCHEMBL649953 0.79 GPR119 (0.47) USP30GPR119LIPE
SCHEMBL653024 0.79 GPR119 (0.47) USP30GPR119LIPE
SCHEMBL650888 0.79 GPR119 (0.47) USP30GPR119LIPE
SCHEMBL30126593 0.77 PIK3CD (0.44) USP30PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL29781273 0.77 PIK3CD (0.48) PIK3CDPIK3CAPIK3CBPIK3CGGPR119
SCHEMBL30127280 0.76 PDE4B (0.52) USP30PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2884981 0.76 GPR119 (0.52) USP30GPR119LIPEJAK1

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-2022266458-A1 6-HETEROCYCLOALKYL-QUINAZOLINE DERIVATIVES AND USES THEREOF BLACK DIAMOND THERAPEUTICS, INC. (US) 2022-12-22 — — WO disclosed
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