SCHEMBL6992883

SCHEMBL6992883

[CH2]COCc1coc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.46
CA2 P00918 1/20 0.44
CYP11B1 P15538 3/20 0.39
CYP11B2 P19099 3/20 0.39
CYP17A1 P05093 1/20 0.39
CYP19A1 P11511 1/20 0.39
IL4I1 Q96RQ9 1/20 0.38
PSMB5 P28074 4/20 0.38
PSMB8 P28062 3/20 0.38
MAOA P21397 2/20 0.36
SIGMAR1 Q99720 1/20 0.36
PTPN1 P18031 1/20 0.35

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
SCHEMBL6001166 0.83 MAOB (0.44) MAOBCA2CYP11B1CYP11B2CYP17A1
SCHEMBL2092249 0.79 MAOB (0.53) MAOBCA2CYP11B1CYP11B2CYP17A1
SCHEMBL7360353 0.76 MAOB (0.50) MAOBCA2CYP11B1CYP11B2CYP17A1
SCHEMBL4248680 0.75 MAOB (0.46) MAOBCA2CYP11B1CYP11B2CYP17A1
SCHEMBL13610227 0.74 FAAH (0.47) MAOBCA2PSMB5PSMB8
SCHEMBL6992879 0.74 CA2 (0.46) MAOBCA2CYP11B1CYP11B2CYP17A1
SCHEMBL28410649 0.74 MAOB (0.49) MAOBCA2PSMB5PSMB8
SCHEMBL6002749 0.73 MAOB (0.47) MAOBCA2CYP11B1CYP11B2CYP17A1
SCHEMBL6511946 0.72 MAOB (0.71) MAOBCA2CYP11B1CYP11B2CYP17A1
SCHEMBL2094752 0.71 MAOB (0.46) MAOBCA2CYP11B1CYP11B2CYP17A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0859004-B1 Piperidine derivatives having anxiolytic effect LUNDBECK & CO AS H (DK) 2003-05-02 EP disclosed
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-0593511-A1 PIPERIDINE DERIVATES HAVING ANXIOLYTIC EFFECT H. LUNDBECK A/S (DK) 1994-04-27 EP disclosed
WO-1992022554-A1 PIPERIDINE DERIVATES HAVING ANXIOLYTIC EFFECT H. LUNDBECK A/S (DK) 1992-12-23 WO disclosed
EP-0518805-A1 Piperidine derivatives H. LUNDBECK A/S (DK) 1992-12-16 EP disclosed