SCHEMBL4885001

SCHEMBL4885001

COc1cccc(C(CN2CCN(Cc3ccccc3)CC2)C2(O)CCCCC2)c1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 18/20 0.76
SLC6A4 P31645 3/20 0.58
SLC6A3 Q01959 6/20 0.58
SIGMAR1 Q99720 1/20 0.56

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
SCHEMBL9321165 0.92 SLC6A2 (0.70) SLC6A2SLC6A4SLC6A3
SCHEMBL9320630 0.90 SLC6A2 (0.64) SLC6A2SLC6A4SLC6A3SIGMAR1
SCHEMBL13712841 0.87 SLC6A2 (0.77) SLC6A2SLC6A4
SCHEMBL9321387 0.84 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3
SCHEMBL13712095 0.84 SLC6A2 (0.64) SLC6A2SLC6A4SLC6A3
SCHEMBL13712101 0.83 SLC6A2 (0.64) SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL3955764 0.83 SLC6A2 (0.65) SLC6A2SLC6A4SLC6A3
SCHEMBL9321548 0.83 SLC6A2 (0.52) SLC6A2SLC6A4SLC6A3
SCHEMBL13712112 0.83 SLC6A2 (0.66) SLC6A2SLC6A4SLC6A3
SCHEMBL9320600 0.82 SLC6A2 (0.60) SLC6A2SLC6A4SLC6A3

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1551413-A1 USE OF NOREPINEPHRINE REUPTAKE MODULATORS FOR PREVENTING AND TREATING VASOMOTOR SYMPTOMS Wyeth a Corporation of the State of Delaware (US) 2005-07-13 EP claimed
EP-1551380-A1 A METHOD OF TREATING VASOMOTOR SYMPTOMS COMPRISING A COMPOUND HAVING NOREPINEPHRINE REUPTAKE INHIBITOR ACTIVITY AND 5-HT2A ANTAGONISTIC ACTIVITY Wyeth (US) 2005-07-13 EP claimed
US-20050130987-A1 Methods of treating vasomotor symptoms WYETH (US) 2005-06-16 US claimed
US-20040152710-A1 Use of norepinephrine reuptake modulators for preventing and treating vasomotor symptoms WYETH 2004-08-05 US claimed
WO-2004035036-A1 A METHOD OF TREATING VASOMOTOR SYMPTOMS COMPRISING A COMPOUND HAVING NOREPINEPHRINE REUPTAKE INHIBITOR ACTIVITY AND 5-HT2A ANTAGONISTIC ACTIVITY WYETH (US) 2004-04-29 WO claimed
WO-2004035058-A1 USE OF NOREPINEPHRINE REUPTAKE MODULATORS FOR PREVENTING AND TREATING VASOMOTOR SYMPTOMS WYETH (US) 2004-04-29 WO claimed
EP-0310268-B1 Substituted cycloalkanols AMERICAN HOME PROD (US) 1994-02-02 EP claimed
US-4826844-A ANTIDEPRESSANT, ANXIOLYTIC AGENT AMERICAN HOME PRODUCTS CORPORATION (US) 1989-05-02 US claimed
EP-0310268-A2 Substituted cycloalkanols AMERICAN HOME PRODUCTS CORPORATION (US) 1989-04-05 EP claimed
US-20080227850-A1 USE OF NOREPINEPHRINE REUPTAKE MODULATORS FOR PREVENTING AND TREATING VASOMOTOR SYMPTOMS WYETH (US) 2008-09-18 US disclosed
WO-2008060397-A2 METHOD OF TREATING THERMOREGULATORY DISFUNCTION NOVEN THERAPEUTICS, LLC (US) 2008-05-22 WO disclosed
US-7345096-B2 Use of norepinephrine reuptake modulators for preventing and treating vasomotor symptoms WYETH (US) 2008-03-18 US disclosed
EP-1846105-A2 USE OF ADRENERGIC ALPHA2B ANTAGONISTS FOR THE TREATMENT OF VASOMOTOR SYMPTOMS Wyeth (US) 2007-10-24 EP disclosed
EP-1551380-A1 A METHOD OF TREATING VASOMOTOR SYMPTOMS COMPRISING A COMPOUND HAVING NOREPINEPHRINE REUPTAKE INHIBITOR ACTIVITY AND 5-HT2A ANTAGONISTIC ACTIVITY Wyeth (US) 2005-07-13 EP disclosed
WO-2004035036-A1 A METHOD OF TREATING VASOMOTOR SYMPTOMS COMPRISING A COMPOUND HAVING NOREPINEPHRINE REUPTAKE INHIBITOR ACTIVITY AND 5-HT2A ANTAGONISTIC ACTIVITY WYETH (US) 2004-04-29 WO disclosed
WO-2004035035-A1 USE OF NOREPINEPHRINE REUPTAKE MODULATORS FOR PREVENTING AND TREATING VASOMOTOR SYMPTOMS WYETH (US) 2004-04-29 WO disclosed
WO-2004035058-A1 USE OF NOREPINEPHRINE REUPTAKE MODULATORS FOR PREVENTING AND TREATING VASOMOTOR SYMPTOMS WYETH (US) 2004-04-29 WO disclosed
EP-0310268-B1 Substituted cycloalkanols AMERICAN HOME PROD (US) 1994-02-02 EP disclosed
US-4826844-A ANTIDEPRESSANT, ANXIOLYTIC AGENT AMERICAN HOME PRODUCTS CORPORATION (US) 1989-05-02 US disclosed
EP-0310268-A2 Substituted cycloalkanols AMERICAN HOME PRODUCTS CORPORATION (US) 1989-04-05 EP disclosed