SCHEMBL7414870

SCHEMBL7414870

Fc1ccc(C=CCC2CCCN2)cc1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.43
AKT1 P31749 1/20 0.37
CHRM3 P20309 1/20 0.37
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36

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
SCHEMBL7414863 1.00 LTA4H (0.43) LTA4HAKT1CHRM3CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL7416897 0.98 LTA4H (0.43) LTA4HAKT1CHRM3CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL7416892 0.98 LTA4H (0.43) LTA4HAKT1CHRM3CHRNB4CHRNA3
SCHEMBL7407987 0.95 LTA4H (0.49) LTA4H
SCHEMBL7419865 0.95 LTA4H (0.49) LTA4H
SCHEMBL7407991 0.95 LTA4H (0.49) LTA4H
Hydrochloric Acid SCHEMBL7414688 0.94 LTA4H (0.48) LTA4H
Hydrochloric Acid SCHEMBL7414695 0.94 LTA4H (0.48) LTA4H
SCHEMBL7406748 0.84 POLB (0.47) LTA4HCHRNB4CHRNA3
SCHEMBL7406753 0.84 POLB (0.47) LTA4HCHRNB4CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0734379-B1 2-ARYLALKENYL-AZACYCLOALKANE DERIVATIVES AS SIGMA RECEPTOR LIGANDS, PREPARATION METHOD THEREFOR AND THERAPEUTICAL USE THEREOF PARKE DAVIS (FR) 2001-03-07 EP disclosed
EP-0995436-A2 Ligands for sigma receptors and their therapeutical applications PARKE-DAVIS (FR) 2000-04-26 EP disclosed
US-6013656-A PSYCHOLOGICAL DISORDERS; GASTROINTESTINAL DISORDERS; NERVOUSSYSTEM DISORDERS WARNER-LAMBERT COMPANY (US) 2000-01-11 US disclosed
US-5849760-A 2-(arylalkenyl)azacycloalkane derivatives as ligands for sigma receptors INSTITUT DE RECHERCHE JOUVEINAL (FR) 1998-12-15 US disclosed
EP-0734379-A1 NOVEL 2-ARYLALKENYL-AZACYCLOALKANE DERIVATIVES AS SIGMA RECEPTOR LIGANDS, PREPARATION METHOD THEREFOR AND THERAPEUTICAL USE THEREOF INSTITUT DE RECHERCHE JOUVEINAL (I.R.J) (FR) 1996-10-02 EP disclosed
WO-1995015948-A1 NOVEL 2-ARYLALKENYL-AZACYCLOALKANE DERIVATIVES AS SIGMA RECEPTOR LIGANDS, PREPARATION METHOD THEREFOR AND THERAPEUTICAL USE THEREOF INSTITUT DE RECHERCHE JOUVEINAL (FR) 1995-06-15 WO disclosed