SCHEMBL26082102

SCHEMBL26082102

C[C@@H](C(=O)NC(C)(C)C)N1CCC(CNC(=O)c2cc(F)cc(OC(F)F)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 11/20 0.51
CACNA1I Q9P0X4 9/20 0.51
CACNA1G O43497 1/20 0.51
KCNH2 Q12809 9/20 0.46
CYP2D6 P10635 2/20 0.42
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL26082106 1.00 CACNA1H (0.51) CACNA1HCACNA1ICACNA1GKCNH2CYP2D6
SCHEMBL26082097 1.00 CACNA1H (0.51) CACNA1HCACNA1ICACNA1GKCNH2CYP2D6
SCHEMBL26082109 0.85 CACNA1I (0.69) CACNA1HCACNA1ICACNA1GKCNH2CYP2D6
SCHEMBL4271126 0.85 CACNA1I (0.69) CACNA1HCACNA1ICACNA1GKCNH2CYP2D6
SCHEMBL26082111 0.85 CACNA1I (0.69) CACNA1HCACNA1ICACNA1GKCNH2CYP2D6
SCHEMBL26083561 0.83 CACNA1I (0.45) CACNA1HCACNA1ICACNA1GKCNH2CYP2D6
SCHEMBL26083045 0.83 CACNA1I (0.45) CACNA1HCACNA1ICACNA1GKCNH2CYP2D6
SCHEMBL26082105 0.83 CACNA1I (0.45) CACNA1HCACNA1ICACNA1GKCNH2CYP2D6
SCHEMBL26081978 0.81 CACNA1I (0.52) CACNA1HCACNA1ICACNA1GKCNH2CYP2D6
SCHEMBL26082512 0.80 CACNA1I (0.63) CACNA1HCACNA1ICACNA1GKCNH2CYP2D6

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