SCHEMBL26465689

SCHEMBL26465689

Cc1cc(F)cc(NC(=O)CN2CC3CC(C2)N3CC(=O)NC(C)(C)C)c1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 11/20 0.54
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
ATM Q13315 1/20 0.39
CACNA1G O43497 1/20 0.39
CACNA1I Q9P0X4 1/20 0.39
ACKR3 P25106 1/20 0.38
DRD4 P21917 1/20 0.38
ALDH1A1 P00352 2/20 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
SCHEMBL26464490 0.89 CACNA1H (0.54) CACNA1HCACNA1GCACNA1I
SCHEMBL26465573 0.87 CACNA1H (0.72) CACNA1HMEN1KMT2ALMNAACKR3
SCHEMBL26465704 0.86 CACNA1H (0.51) CACNA1HCACNA1GCACNA1I
SCHEMBL26498774 0.84 ALDH1A1 (0.53) CACNA1HMEN1KMT2ALMNAATM
SCHEMBL26466012 0.84 CACNA1H (0.45) CACNA1HMEN1KMT2AATMDRD4
SCHEMBL26465838 0.83 CACNA1H (0.55) CACNA1HCACNA1GCACNA1IDRD4ALDH1A1
SCHEMBL26463608 0.82 CACNA1H (0.56) CACNA1HCACNA1GCACNA1I
SCHEMBL26464783 0.82 CACNA1H (0.46) CACNA1HKMT2ACACNA1GCACNA1I
SCHEMBL26465699 0.80 HPGD (0.55) CACNA1HMEN1KMT2ALMNAMAPT
SCHEMBL26465810 0.79 CACNA1H (0.47) CACNA1HLMNAMAPTCACNA1GALDH1A1

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-2023192669-A1 T-TYPE CALCIUM CHANNEL MODULATORS COMPRISING A PIPERAZINE OR 1,4-DIAZEPANE CORE AND METHODS OF USE THEREOF PRAXIS PRECISION MEDICINES, INC. (US) 2023-10-05 WO disclosed