SCHEMBL30794535

SCHEMBL30794535

CSc1nc(N2CCOCC2)cc(C)c1C(=O)NCc1ccc(C(F)(F)F)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRAF P15056 11/20 0.48
NAPEPLD Q6IQ20 2/20 0.46
MCHR1 Q99705 1/20 0.46
TACR1 P25103 1/20 0.44
LMNA P02545 1/20 0.43
RAF1 P04049 10/20 0.43
GAA P10253 1/20 0.42
PIK3CA P42336 1/20 0.42
MAPT P10636 1/20 0.42
STAT3 P40763 1/20 0.42
SMN1; SMN2 Q16637 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
SCHEMBL2130908 1.00 BRAF (0.48) BRAFNAPEPLDMCHR1TACR1LMNA
SCHEMBL30794720 0.91 BRAF (0.47) BRAFNAPEPLDMCHR1TACR1LMNA
SCHEMBL2131408 0.91 BRAF (0.47) BRAFNAPEPLDMCHR1TACR1LMNA
SCHEMBL2130924 0.90 TP53 (0.48) NAPEPLDLMNAGAAPIK3CAMAPT
SCHEMBL2131731 0.88 MEN1 (0.52) NAPEPLDLMNAPIK3CASMN1; SMN2
SCHEMBL2128264 0.86 PPARG (0.48) NAPEPLDLMNAPIK3CAMAPT
SCHEMBL2130613 0.85 BRAF (0.48) BRAFNAPEPLDMCHR1TACR1LMNA
SCHEMBL30795711 0.85 KCNQ3 (0.50) BRAFNAPEPLDMCHR1TACR1LMNA
SCHEMBL30795518 0.85 BRAF (0.48) BRAFNAPEPLDMCHR1TACR1LMNA
SCHEMBL2129798 0.85 KCNQ3 (0.50) BRAFNAPEPLDMCHR1TACR1LMNA

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