SCHEMBL20056147

SCHEMBL20056147

CCN1CCC(CNC(=O)c2cc(Cl)cc(OC)c2)CC1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CACNA1I Q9P0X4 16/20 0.62
KCNH2 Q12809 13/20 0.62
CACNA1H O95180 4/20 0.57
CYP2D6 P10635 2/20 0.55
CACNA1G O43497 1/20 0.53
POLB P06746 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL26082773 0.85 CACNA1I (0.72) CACNA1IKCNH2CACNA1HCYP2D6CACNA1G
SCHEMBL20056313 0.84 CACNA1I (0.62) CACNA1IKCNH2CACNA1HCACNA1GPOLB
SCHEMBL26082093 0.84 CACNA1I (0.84) CACNA1IKCNH2CACNA1HCYP2D6CACNA1G
SCHEMBL19113212 0.84 KCNH2 (0.59) CACNA1IKCNH2CACNA1HCYP2D6CACNA1G
SCHEMBL14763517 0.83 CACNA1I (0.67) CACNA1IKCNH2CACNA1HCYP2D6CACNA1G
SCHEMBL4280786 0.83 CACNA1I (0.63) CACNA1IKCNH2CACNA1HCYP2D6CACNA1G
SCHEMBL4277996 0.82 KCNH2 (0.56) CACNA1IKCNH2CACNA1HCYP2D6CACNA1G
SCHEMBL14708784 0.82 CACNA1I (0.59) CACNA1IKCNH2CACNA1HCYP2D6CACNA1G
SCHEMBL8374124 0.82 KCNH2 (0.59) CACNA1IKCNH2CACNA1HCYP2D6CACNA1G
SCHEMBL4275757 0.81 KCNH2 (0.55) CACNA1IKCNH2CACNA1HCYP2D6CACNA1G

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3189839-B1 N-PIPERIDINYL ACETAMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS PRAXIS PREC MEDICINES INC (US) 2020-05-20 EP disclosed
EP-2300007-B1 N-PIPERIDINYL ACETAMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS TARO PHARMACEUTICALS INC (CA) 2018-04-18 EP disclosed