SCHEMBL7439197

SCHEMBL7439197

c1ccc(CCCCN2CCC3(CC2)Oc2ccccc2O3)cc1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.58
CCR3 P51677 2/20 0.56
OPRM1 P35372 1/20 0.56
POLB P06746 1/20 0.53
DRD2 P14416 1/20 0.52
HTR2A P28223 1/20 0.52
HTR1A P08908 1/20 0.52

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
SCHEMBL8555156 0.89 SIGMAR1 (0.47) SIGMAR1OPRM1DRD2HTR2A
SCHEMBL7439064 0.80 DRD2 (0.83) SIGMAR1CCR3OPRM1DRD2HTR2A
SCHEMBL7442602 0.78 ADRA1D (0.60) SIGMAR1CCR3OPRM1DRD2HTR2A
SCHEMBL8092982 0.77 SIGMAR1 (0.85) SIGMAR1CCR3
SCHEMBL8935099 0.76 SIGMAR1 (0.96) SIGMAR1CCR3
SCHEMBL17861586 0.75 DRD2 (0.60) SIGMAR1DRD2HTR2A
SCHEMBL4425957 0.74 SIGMAR1 (0.90) SIGMAR1CCR3POLB
SCHEMBL113897 0.74 SIGMAR1 (0.96) SIGMAR1CCR3
SCHEMBL7366514 0.74 SIGMAR1 (1.00) SIGMAR1CCR3
SCHEMBL10601122 0.74 SIGMAR1 (0.96) SIGMAR1CCR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6207677-B1 ADMINISERING SIGMA RECEPTOR BINDING PIPERIDINE DERIVATIVE FOR TREATING ANXIETY, EPILEPSY, CONVULSION, MOVEMENT DISORDER, AMNESIA H. LUNDBECK A/S (DK) 2001-03-27 US disclosed
US-6031099-A Piperidine derivates having anxiolytic effect H. LUNDBECK A/S (DK) 2000-02-29 US disclosed
US-5807871-A PSYCHOLOGICAL DISORDERS, ALZHEIMER OR PARKINSON DISEASE H. LUNDBECK A/S (DK) 1998-09-15 US disclosed
EP-0593511-B1 PIPERIDINE DERIVATES HAVING ANXIOLYTIC EFFECT LUNDBECK & CO AS H (DK) 1998-09-02 EP disclosed
EP-0859004-A1 Piperidine derivatives having anxiolytic effect H. LUNDBECK A/S (DK) 1998-08-19 EP disclosed
EP-0853085-A1 Piperidine derivatives having anxiolytic effect H. LUNDBECK A/S (DK) 1998-07-15 EP disclosed
US-5665725-A Piperidine derivatives having anxiolytic effect Lundbeck, H. (DK) 1997-09-09 US disclosed
EP-0518805-A1 Piperidine derivatives H. LUNDBECK A/S (DK) 1992-12-16 EP disclosed