SCHEMBL26082041

SCHEMBL26082041

CCC(C)(C)NC(=O)CN1CC2(CC(CNC(=O)c3ccc(F)c(OC(F)F)c3)C2)C1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 7/20 0.39
CACNA1I Q9P0X4 4/20 0.39
CACNA1G O43497 1/20 0.39
F10 P00742 3/20 0.36
PDE4A P27815 4/20 0.35
PDE4B Q07343 4/20 0.35
PDE4C Q08493 4/20 0.35
PDE4D Q08499 4/20 0.35
KCNH2 Q12809 2/20 0.34
HTR4 Q13639 1/20 0.34

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
SCHEMBL26082026 0.93 CACNA1H (0.47) CACNA1HCACNA1ICACNA1GF10PDE4A
SCHEMBL26082038 0.90 CACNA1H (0.39) CACNA1HCACNA1ICACNA1GF10PDE4A
SCHEMBL26083480 0.87 CACNA1I (0.53) CACNA1HCACNA1ICACNA1GF10KCNH2
SCHEMBL26541960 0.83 CACNA1H (0.50) CACNA1HCACNA1ICACNA1GF10PDE4A
SCHEMBL26082103 0.82 PDE4A (0.38) CACNA1HCACNA1ICACNA1GF10PDE4A
SCHEMBL26082099 0.82 PDE4A (0.38) CACNA1HCACNA1ICACNA1GF10PDE4A
SCHEMBL26081910 0.81 CACNA1H (0.41) CACNA1HCACNA1ICACNA1GKCNH2
SCHEMBL26083463 0.79 CACNA1I (0.62) CACNA1HCACNA1ICACNA1GF10KCNH2
SCHEMBL26082028 0.78 CACNA1H (0.43) CACNA1HCACNA1ICACNA1G
SCHEMBL26083479 0.77 CACNA1I (0.53) CACNA1HCACNA1ICACNA1GF10KCNH2

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-2023192687-A1 T-TYPE CALCIUM CHANNEL MODULATORS COMPRISING AN AZASPIROHEPTANE CORE AND METHODS OF USE THEREOF PRAXIS PRECISION MEDICINES, INC. (US) 2023-10-05 WO disclosed