SCHEMBL7309705

SCHEMBL7309705

CC1C(N2CCN(CCC(=O)O)CC2)OC(=O)N1CCCC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.47
ACHE P22303 10/20 0.45
BCHE P06276 3/20 0.44
FAAH O00519 1/20 0.44
CHRM4 P08173 1/20 0.41

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
SCHEMBL7304426 0.97 LTA4H (0.47) LTA4HACHEBCHEFAAHCHRM4
SCHEMBL7307208 0.96 LTA4H (0.49) LTA4HACHEBCHEFAAH
SCHEMBL7308443 0.95 ACHE (0.46) LTA4HACHEBCHE
SCHEMBL7312963 0.93 LTA4H (0.48) LTA4HACHEBCHEFAAH
SCHEMBL7313953 0.92 ACHE (0.45) LTA4HACHEBCHEFAAHCHRM4
SCHEMBL7311514 0.91 ACHE (0.42) LTA4HACHEBCHEFAAHCHRM4
SCHEMBL7303537 0.91 LTA4H (0.47) LTA4HACHEBCHEFAAH
SCHEMBL7307606 0.91 CHRM2 (0.43) CHRM4
SCHEMBL7311744 0.91 HTR7 (0.43) CHRM4
SCHEMBL7313262 0.90 ACHE (0.42) LTA4HACHEBCHEFAAHCHRM4

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