SCHEMBL27458686

SCHEMBL27458686

CC(C)(C)OC(=O)N1CCc2cnc(N)nc21

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.41
PIK3R1 P27986 12/20 0.40
PIK3CA P42336 12/20 0.40
MAPT P10636 2/20 0.40
PIK3CD O00329 2/20 0.39
PIK3CB P42338 2/20 0.39
CYP11B2 P19099 1/20 0.38
HRH4 Q9H3N8 1/20 0.38
ESR2 Q92731 1/20 0.37

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
SCHEMBL30954006 1.00 NR1H2 (0.41) NR1H2PIK3R1PIK3CAMAPTPIK3CD
SCHEMBL27458692 0.85 MAPT (0.41) NR1H2PIK3R1PIK3CAMAPTPIK3CD
SCHEMBL27458695 0.84 MAPT (0.42) NR1H2MAPTCYP11B2ESR2
SCHEMBL30513283 0.78 CYP11B2 (0.41) NR1H2MAPTCYP11B2ESR2
SCHEMBL22803887 0.77 NR1H2 (0.54) NR1H2PIK3R1PIK3CAMAPTESR2
SCHEMBL18053895 0.76 NR1H2 (0.44) NR1H2MAPTCYP11B2ESR2
SCHEMBL14380649 0.76 ESR2 (0.44) NR1H2MAPTESR2
SCHEMBL26640804 0.75 NR1H2 (0.41) NR1H2PIK3R1PIK3CAMAPT
SCHEMBL10053887 0.75 CYP11B2 (0.45) NR1H2MAPTCYP11B2ESR2
SCHEMBL3530060 0.74 MAPT (0.65) NR1H2MAPTESR2

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-2024137984-A1 INHIBITORS OF KIF18A AND USES THEREOF ACCENT THERAPEUTICS, INC. (US) 2024-06-27 WO disclosed