SCHEMBL7412149

SCHEMBL7412149

O=C(C1CC1)N1CCCCC1CC=Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.44
KDM4E B2RXH2 4/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CHRM3 P20309 2/20 0.41
HPGD P15428 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MCHR1 Q99705 1/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL7408764 1.00 HRH3 (0.44) HRH3KDM4ESMN1; SMN2CHRM3HPGD
SCHEMBL7406854 1.00 HRH3 (0.44) HRH3KDM4ESMN1; SMN2CHRM3HPGD
SCHEMBL7415767 0.96 HRH3 (0.43) HRH3KDM4ESMN1; SMN2CHRM3HPGD
SCHEMBL7415772 0.96 HRH3 (0.43) HRH3KDM4ESMN1; SMN2CHRM3HPGD
SCHEMBL7414755 0.96 KDM4E (0.46) HRH3KDM4ESMN1; SMN2CHRM3HPGD
SCHEMBL7414444 0.96 KDM4E (0.46) HRH3KDM4ESMN1; SMN2CHRM3HPGD
SCHEMBL7414441 0.96 KDM4E (0.46) HRH3KDM4ESMN1; SMN2CHRM3HPGD
SCHEMBL7412640 0.92 ALDH1A1 (0.46) HRH3KDM4ESMN1; SMN2CHRM3HPGD
SCHEMBL7412636 0.92 ALDH1A1 (0.46) HRH3KDM4ESMN1; SMN2CHRM3HPGD
SCHEMBL7816906 0.88 TRPM8 (0.40) HRH3KDM4ESMN1; SMN2HPGDALDH1A1

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