SCHEMBL8844754

SCHEMBL8844754

CCN(CC)CC1CCN(C(=O)Oc2ccc(Oc3ccccc3)cc2)CC1

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.63
RAB9A P51151 1/20 0.63
GAA P10253 1/20 0.56
NPY2R P49146 5/20 0.50
LIPE Q05469 1/20 0.46

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
SCHEMBL8844800 0.87 NPC1 (0.56) NPC1RAB9AGAANPY2RLIPE
SCHEMBL8845027 0.86 NPC1 (0.71) NPC1RAB9AGAANPY2RLIPE
SCHEMBL8844794 0.84 NPC1 (0.67) NPC1RAB9AGAANPY2RLIPE
SCHEMBL8844965 0.82 NPC1 (0.72) NPC1RAB9AGAALIPE
SCHEMBL8844771 0.81 NPC1 (0.71) NPC1RAB9AGAALIPE
SCHEMBL10089213 0.81 GAA (0.70) NPC1RAB9AGAANPY2R
Iodide SCHEMBL8844833 0.80 NPC1 (0.69) NPC1RAB9AGAALIPE
Iodide SCHEMBL8844876 0.80 NPC1 (0.62) NPC1RAB9AGAANPY2RLIPE
SCHEMBL9542280 0.80 NPC1 (0.62) NPC1RAB9AGAANPY2R
SCHEMBL2597837 0.79 GAA (0.88) NPC1RAB9AGAANPY2RLIPE

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-5602151-A ADMINISTERING TO MAMMALS TO REDUCE SERUM CHOLESTEROL LEVELS AMERICAN HOME PRODUCTS CORPORATION (US) 1997-02-11 US claimed
US-5602151-A ADMINISTERING TO MAMMALS TO REDUCE SERUM CHOLESTEROL LEVELS AMERICAN HOME PRODUCTS CORPORATION (US) 1997-02-11 US disclosed
US-5512565-A REDUCE CHOLESTEROL ABSORPTION IN MAMMALS AMERICAN HOME PRODUCTS CORPORATION (US) 1996-04-30 US disclosed
EP-0428385-A1 Cholesterol ester hydrolase inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 1991-05-22 EP disclosed