SCHEMBL30794748

SCHEMBL30794748

Cc1cc(N2CCOCC2)nc(N2CCCC2)c1C(=O)NCc1cccc(F)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ SRC P12931 1/20 0.47
▸ LMNA P02545 4/20 0.45
▸ CALCA P06881 1/20 0.45
▸ NAPEPLD Q6IQ20 1/20 0.44
▸ PIK3CA P42336 3/20 0.44
▸ TP53 P04637 3/20 0.44
▸ PIK3CB P42338 2/20 0.44
▸ PIK3CD O00329 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ PIK3CG P48736 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ POLB P06746 1/20 0.42

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
SCHEMBL2129643 1.00 SMN1; SMN2 (0.47) SMN1; SMN2SRCLMNACALCANAPEPLD
SCHEMBL30795947 0.97 SRC (0.49) SRCLMNANAPEPLDPIK3CATP53
SCHEMBL2134192 0.97 SRC (0.49) SRCLMNANAPEPLDPIK3CATP53
SCHEMBL2129359 0.88 SRC (0.49) SMN1; SMN2SRCLMNANAPEPLDPIK3CA
SCHEMBL2133149 0.88 SRC (0.49) SRCNAPEPLDPIK3CAPIK3CBPIK3CD
SCHEMBL2132270 0.87 SRC (0.48) SRCLMNATP53ALDH1A1HPGD
SCHEMBL2128348 0.87 KCNQ3 (0.48) SMN1; SMN2SRCLMNANAPEPLDPIK3CA
SCHEMBL30795803 0.86 SRC (0.47) SRCLMNANAPEPLDPIK3CAPIK3CB
SCHEMBL2129743 0.86 SRC (0.47) SRCLMNANAPEPLDPIK3CAPIK3CB
SCHEMBL2128983 0.85 SRC (0.47) SRCLMNANAPEPLDPIK3CATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4584250-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS Biohaven Therapeutics Ltd. (VG) 2025-07-16 — — EP disclosed
EP-4580679-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND NMDA RECEPTOR ANTAGONISTS Biohaven Therapeutics Ltd. (VG) 2025-07-09 — — EP disclosed
WO-2024054811-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-14 — — WO 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
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