SCHEMBL13569701

SCHEMBL13569701

C=C(CN1CCC(CNC(=O)c2cc(F)cc(C(F)(F)F)c2)CC1)NC1(C)CCC1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CACNA1I Q9P0X4 9/20 0.55
KCNH2 Q12809 9/20 0.55
CACNA1H O95180 4/20 0.51
CACNA1G O43497 1/20 0.51
ALDH1A1 P00352 1/20 0.40
MCHR1 Q99705 1/20 0.40
CCR2 P41597 1/20 0.40
PIK3CA P42336 1/20 0.40

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
SCHEMBL4284041 0.92 CACNA1I (0.58) CACNA1IKCNH2CACNA1HCACNA1GCCR2
SCHEMBL13569815 0.92 CACNA1I (0.60) CACNA1IKCNH2CACNA1HCACNA1GMCHR1
SCHEMBL20056293 0.88 CACNA1I (0.55) CACNA1IKCNH2CACNA1HCACNA1GMCHR1
SCHEMBL4277343 0.85 KCNH2 (0.54) CACNA1IKCNH2CACNA1HCACNA1GALDH1A1
SCHEMBL13569693 0.83 CACNA1I (0.59) CACNA1IKCNH2CACNA1HCACNA1G
SCHEMBL4280554 0.83 CACNA1I (0.64) CACNA1IKCNH2CACNA1HCACNA1GMCHR1
SCHEMBL26082029 0.81 CACNA1H (0.60) CACNA1IKCNH2CACNA1HCACNA1GCCR2
SCHEMBL4276850 0.81 CACNA1I (0.61) CACNA1IKCNH2CACNA1HCACNA1GALDH1A1
SCHEMBL4274643 0.80 CACNA1H (0.77) CACNA1IKCNH2CACNA1HCACNA1G
SCHEMBL21952106 0.80 KCNH2 (0.60) CACNA1IKCNH2CACNA1HCACNA1GCCR2

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-A1 N-PIPERIDINYL ACETAMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS Taro Pharmaceuticals Inc. (CA) 2017-07-12 EP disclosed
WO-2009146540-A1 N-PIPERIDINYL ACETAMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS NEUROMED PHARMACEUTICALS LTD (CA) 2009-12-10 WO disclosed