SCHEMBL30814195

SCHEMBL30814195

CC(=O)N(C)c1nc(N2CCOCC2)cc(C)c1C(=O)NCc1cccc(F)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NAPEPLD Q6IQ20 5/20 0.46
▸ SRC P12931 1/20 0.45
▸ PIK3CA P42336 4/20 0.42
▸ PIK3CB P42338 4/20 0.42
▸ PIK3CD O00329 2/20 0.42
▸ PIK3CG P48736 2/20 0.42
▸ KLKB1 P03952 1/20 0.40
▸ KLK1 P06870 1/20 0.40
▸ AKT1 P31749 1/20 0.40
▸ GBA1 P04062 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ HPGD P15428 1/20 0.40

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
SCHEMBL2129329 1.00 NAPEPLD (0.46) NAPEPLDSRCPIK3CAPIK3CBPIK3CD
SCHEMBL2129755 0.92 NAPEPLD (0.48) NAPEPLDSRCPIK3CAPIK3CBPIK3CD
SCHEMBL30795808 0.92 NAPEPLD (0.48) NAPEPLDSRCPIK3CAPIK3CBPIK3CD
SCHEMBL10278853 0.91 NAPEPLD (0.47) NAPEPLDPIK3CAPIK3CBPIK3CDPIK3CG
SCHEMBL2130486 0.90 NAPEPLD (0.48) NAPEPLDSRCPIK3CAPIK3CBPIK3CD
SCHEMBL30795788 0.90 NAPEPLD (0.48) NAPEPLDSRCPIK3CAPIK3CBPIK3CD
SCHEMBL2133149 0.86 SRC (0.49) NAPEPLDSRCPIK3CAPIK3CBPIK3CD
SCHEMBL30795947 0.86 SRC (0.49) NAPEPLDSRCPIK3CAPIK3CBPIK3CD
SCHEMBL2129359 0.86 SRC (0.49) NAPEPLDSRCPIK3CAPIK3CBPIK3CD
SCHEMBL2134192 0.86 SRC (0.49) NAPEPLDSRCPIK3CAPIK3CBPIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4580679-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND NMDA RECEPTOR ANTAGONISTS Biohaven Therapeutics Ltd. (VG) 2025-07-09 — — EP disclosed
WO-2024054807-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND TDP-43 MODULATORS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-14 — — WO disclosed
WO-2024050389-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND NMDA RECEPTOR ANTAGONISTS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-07 — — WO disclosed
Send feedback