SCHEMBL9407417

SCHEMBL9407417

CCCCCCCCCCCCCCCCCCOP(=O)([O-])OC1CCC[N+](C)(C)CC1

nearest known ligand 0.90

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 13/20 0.90
TERT O14746 1/20 0.90
UCHL3 P15374 1/20 0.90
MAPK14 Q16539 1/20 0.90
CDC25A P30304 3/20 0.47
LMNA P02545 2/20 0.46
ESR1 P03372 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
AGTR1 P30556 1/20 0.46
ADRA1A P35348 1/20 0.46
KCNH2 Q12809 1/20 0.46
PRKD3 O94806 1/20 0.38
PRKCG P05129 1/20 0.38
PRKCB P05771 1/20 0.38
PRKCA P17252 1/20 0.38
PRKCH P24723 1/20 0.38
PRKCI P41743 1/20 0.38
PRKCE Q02156 1/20 0.38
PRKCQ Q04759 1/20 0.38
PRKCZ Q05513 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
Perifosine SCHEMBL93872 0.95 AKT1 (1.00) AKT1TERTUCHL3MAPK14CDC25A
SCHEMBL22942075 0.95 AKT1 (1.00) AKT1TERTUCHL3MAPK14CDC25A
SCHEMBL29549430 0.91 AKT1 (0.74) AKT1TERTUCHL3MAPK14CDC25A
SCHEMBL14447874 0.85 AKT1 (0.64) AKT1TERTUCHL3MAPK14CDC25A
SCHEMBL14447880 0.85 AKT1 (0.64) AKT1TERTUCHL3MAPK14CDC25A
SCHEMBL14447873 0.85 AKT1 (0.64) AKT1TERTUCHL3MAPK14CDC25A
SCHEMBL17789850 0.80 AKT1 (0.72) AKT1TERTUCHL3MAPK14CDC25A
SCHEMBL14447925 0.79 TERT (0.57) AKT1TERTUCHL3MAPK14
SCHEMBL14447876 0.79 TERT (0.57) AKT1TERTUCHL3MAPK14
SCHEMBL14447963 0.79 AKT1 (0.71) AKT1TERTUCHL3MAPK14CDC25A

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
EP-0579939-A1 Phospholipid derivatives ASTA Medica Aktiengesellschaft (DE) 1994-01-26 EP claimed