SCHEMBL7303537

SCHEMBL7303537

CC1C(N2CCN(CCCC(=O)O)CC2)OC(=O)N1CCC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.47
ACHE P22303 11/20 0.45
BCHE P06276 2/20 0.44
FAAH O00519 1/20 0.42

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
SCHEMBL7307208 0.96 LTA4H (0.49) LTA4HACHEBCHEFAAH
SCHEMBL7312963 0.95 LTA4H (0.48) LTA4HACHEBCHEFAAH
SCHEMBL7308443 0.95 ACHE (0.46) LTA4HACHEBCHE
SCHEMBL7308778 0.92 LTA4H (0.42) LTA4HACHEBCHE
SCHEMBL7303592 0.91 ACHE (0.42) ACHEBCHE
SCHEMBL7309705 0.91 LTA4H (0.47) LTA4HACHEBCHEFAAH
SCHEMBL7309384 0.91 CHRM2 (0.43)
SCHEMBL7314570 0.91 CACNA1G (0.43)
SCHEMBL7311883 0.91 HTR7 (0.43)
SCHEMBL7304426 0.90 LTA4H (0.47) LTA4HACHEBCHEFAAH

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-0711770-A1 Antagonists of adhesion receptors MERCK PATENT GmbH (DE) 1996-05-15 EP disclosed