SCHEMBL8480700

SCHEMBL8480700

CCCCCCNC(=O)OCCCCCCNC(=O)OC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BCHE P06276 6/20 0.55
ACHE P22303 4/20 0.52
CHRM3 P20309 7/20 0.51
CACNA1F O60840 1/20 0.51
CACNA1D Q01668 1/20 0.51
CACNA1S Q13698 1/20 0.51
CACNA1C Q13936 1/20 0.51
S1PR5 Q9H228 1/20 0.49
NPC1 O15118 1/20 0.48
LMNA P02545 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
ABL1 P00519 1/20 0.48
RIN1 Q13671 1/20 0.48

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
SCHEMBL4464631 0.90 BCHE (0.65) BCHECHRM3NPC1LMNARAB9A
SCHEMBL8710511 0.89 BCHE (0.47) BCHEACHECHRM3CACNA1FCACNA1D
SCHEMBL8717826 0.88 BCHE (0.60) BCHEACHELMNASMN1; SMN2
SCHEMBL8710513 0.87 ACHE (0.45) BCHEACHECHRM3NPC1RAB9A
SCHEMBL8480272 0.84 BCHE (0.63) BCHEACHE
SCHEMBL8482511 0.81 ACHE (0.56) ACHE
SCHEMBL11312955 0.80 BCHE (0.70) BCHEACHEABL1RIN1
SCHEMBL8707756 0.79 NPC1 (0.48) ACHECHRM3NPC1RAB9A
SCHEMBL9233369 0.79 NPC1 (0.48) ACHECHRM3NPC1RAB9A
SCHEMBL9014112 0.78 OPRK1 (0.53) S1PR5NPC1LMNARAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5952506-A Process for the synthesis of 4- 6- (hexylcarbamoyloxy) hexylcarbamoyloxy!-piperidine-1-carboxylic acid 4-phenoxyphenyl ester AMERICAN HOME PRODUCTS CORPORATION (US) 1999-09-14 US claimed
WO-1998047870-A1 PROCESS FOR THE SYNTHESIS OF 4-[6-(HEXYLCARBAMOYLOXY) HEXYLCARBAMOYLOXY]-PIPERIDINE-1- CARBOXYLIC ACID 4-PHENOXYPHENYL ESTER AMERICAN HOME PRODUCTS CORPORATION (US) 1998-10-29 WO claimed
US-5952506-A Process for the synthesis of 4- 6- (hexylcarbamoyloxy) hexylcarbamoyloxy!-piperidine-1-carboxylic acid 4-phenoxyphenyl ester AMERICAN HOME PRODUCTS CORPORATION (US) 1999-09-14 US disclosed
WO-1998047870-A1 PROCESS FOR THE SYNTHESIS OF 4-[6-(HEXYLCARBAMOYLOXY) HEXYLCARBAMOYLOXY]-PIPERIDINE-1- CARBOXYLIC ACID 4-PHENOXYPHENYL ESTER AMERICAN HOME PRODUCTS CORPORATION (US) 1998-10-29 WO disclosed