SCHEMBL9544590

SCHEMBL9544590

CCCCCCNC(=O)OC1CCNCC1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 5/20 0.60
GNAO1 P09471 5/20 0.60
GNAI1 P63096 5/20 0.60
EPHX1 P07099 5/20 0.58
GAA P10253 1/20 0.52
PRCP P42785 2/20 0.51
BCHE P06276 1/20 0.46
NAAA Q02083 1/20 0.45

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
SCHEMBL29991483 0.98 GNAI3 (0.57) GNAI3GNAO1GNAI1EPHX1GAA
SCHEMBL4484094 0.94 GAA (0.58) GNAI3GNAO1GNAI1EPHX1GAA
SCHEMBL8487311 0.92 ACHE (0.57) GNAI3GNAO1GNAI1EPHX1GAA
SCHEMBL29990844 0.87 EPHX1 (0.50) GNAI3GNAO1GNAI1EPHX1GAA
SCHEMBL6695746 0.87 GAA (0.60) EPHX1GAAPRCPBCHENAAA
SCHEMBL8482146 0.86 TDP1 (0.45) GNAI3GNAO1GNAI1EPHX1GAA
SCHEMBL14703637 0.86 EPHX1 (0.62) EPHX1GAANAAA
SCHEMBL3647096 0.85 GAA (0.56) GNAI3GNAO1GNAI1EPHX1GAA
SCHEMBL21059247 0.84 EPHX1 (0.65) EPHX1GAANAAA
SCHEMBL15975473 0.84 EPHX1 (0.65) EPHX1GAANAAA

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
WO-1993013067-A1 4-SUBSTITUTED PIPERIDINECARBOXYLIC ACID ESTERS: INHIBITION OF CHOLESTEROL ABSORPTION AMERICAN HOME PRODUCTS CORPORATION (US) 1993-07-08 WO disclosed
US-5169844-A Enzyme inhibitor, anticholesterol and antilipemic agent AMERICAN HOME PRODUCTS CORPORATION (US) 1992-12-08 US disclosed