SCHEMBL19658530

SCHEMBL19658530

CC(=O)c1ccn(Cc2ccc(F)c(F)c2)n1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CACNA1G O43497 20/20 0.61
CACNA1H O95180 20/20 0.61
CACNA1I Q9P0X4 20/20 0.61
CACNA1C Q13936 1/20 0.55

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
SCHEMBL30587615 0.87 CACNA1G (0.59) CACNA1GCACNA1HCACNA1ICACNA1C
SCHEMBL30587614 0.87 CACNA1G (0.59) CACNA1GCACNA1HCACNA1ICACNA1C
SCHEMBL18365943 0.87 CACNA1G (0.59) CACNA1GCACNA1HCACNA1ICACNA1C
SCHEMBL30587612 0.83 CACNA1G (0.55) CACNA1GCACNA1HCACNA1ICACNA1C
SCHEMBL18366115 0.83 CACNA1G (0.55) CACNA1GCACNA1HCACNA1ICACNA1C
SCHEMBL19659478 0.77 HDAC1 (0.56) CACNA1GCACNA1HCACNA1ICACNA1C
SCHEMBL17316676 0.74 L3MBTL1 (0.65) CACNA1GCACNA1HCACNA1ICACNA1C
SCHEMBL6969733 0.74 CACNA1G (0.46) CACNA1GCACNA1HCACNA1ICACNA1C
SCHEMBL19659010 0.73 MAOA (0.44) CACNA1GCACNA1HCACNA1I
SCHEMBL27364070 0.73 KLKB1 (0.55) CACNA1GCACNA1HCACNA1I

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-2017004500-A9 BICYCLIC LACTAMS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-11-30 WO disclosed