SCHEMBL7288262

SCHEMBL7288262

OC(CNCCCc1ccccc1)COc1cccc2[nH]ccc12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 14/20 0.69
ADRB1 P08588 7/20 0.69
ADRB2 P07550 6/20 0.69
CYP1A2 P05177 2/20 0.60
CYP3A4 P08684 2/20 0.60
LMNA P02545 2/20 0.60
HTR1A P08908 2/20 0.60
KDM4E B2RXH2 1/20 0.60
USP2 O75604 1/20 0.60
CYP2D6 P10635 1/20 0.60
THRB P10828 1/20 0.60
CYP2C9 P11712 1/20 0.60
TSHR P16473 1/20 0.60
TP53 P04637 1/20 0.60
GLA P06280 1/20 0.60
ALOX15 P16050 1/20 0.60
NFKB1 P19838 1/20 0.60
DRD4 P21917 1/20 0.60
HTR1B P28222 1/20 0.60
HTR2C P28335 1/20 0.60

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
SCHEMBL7297780 0.97 ADRB3 (0.68) ADRB3ADRB1ADRB2CYP1A2CYP3A4
SCHEMBL7296273 0.96 ADRB3 (0.67) ADRB3ADRB1ADRB2CYP1A2CYP3A4
SCHEMBL7285328 0.96 ADRB3 (0.67) ADRB3ADRB1ADRB2CYP1A2CYP3A4
SCHEMBL7296138 0.93 ADRB3 (0.78) ADRB3ADRB1ADRB2
SCHEMBL28548618 0.83 ADRB3 (0.52) ADRB3ADRB1ADRB2CYP1A2CYP3A4
SCHEMBL7367227 0.83 HTR1A (0.61) ADRB3ADRB1ADRB2CYP1A2CYP3A4
SCHEMBL11146826 0.83 DRD2 (0.55) ADRB3ADRB1ADRB2CYP1A2CYP3A4
SCHEMBL6056296 0.83 HTR1A (0.71) ADRB3ADRB1ADRB2CYP1A2CYP3A4
SCHEMBL17946159 0.82 ADRB3 (0.67) ADRB3ADRB1ADRB2CYP3A4LMNA
SCHEMBL7412887 0.82 ADRB2 (0.51) ADRB3ADRB1ADRB2CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6169105-B1 POTENTIATING THE ACTION OF PAROXETINE IN INCREASING THE AVAILABILITY OF SEROTONIN, NOREPINEPHRINE AND DOPAMINE IN THE BRAIN BY ADMINISTERING PAROXETINE TO A PATIENT IN NEED THEREOF IN COMBINATION WITH WAY 100635 ELI LILLY AND COMPANY 2001-01-02 US disclosed
US-5958429-A TREATING DEPRESSION ELI LILLY AND COMPANY (US) 1999-09-28 US disclosed
US-5776969-A MIXTURE OF ANTISEROTONIN AGENT AND SEROTONIN RECEPTOR ANTAGONIST ELI LILLY AND COMPANY (US) 1998-07-07 US disclosed
WO-1997031629-A1 TREATMENT OF SLEEP DISORDERS ELI LILLY AND COMPANY (US) 1997-09-04 WO disclosed
EP-0792649-A1 Treatment of sleep disorders ELI LILLY AND COMPANY (US) 1997-09-03 EP disclosed
WO-1997006792-A1 POTENTIATION OF SEROTONIN RESPONSE ELI LILLY AND COMPANY (US) 1997-02-27 WO disclosed
EP-0759299-A1 Potentiation of serotonin response ELI LILLY AND COMPANY (US) 1997-02-26 EP disclosed
US-5552429-A ADMINISTERING FLUOXETINE AND PINDOLOL TO INCREASE AVAILABILITY OF SEROTONIN, DOPAMINE AND NOREPINEPHRINE ELI LILLY AND COMPANY (US) 1996-09-03 US disclosed
US-5538992-A SEROTONIN RECEPTOR ANTAGONIST AND FLUOXETINE FOR INCONTIENCE AND ANTIDEPRESSANTS ELI LILLY AND COMPANY (US) 1996-07-23 US disclosed
US-5532264-A POTENTIATION OF VENLAFAXINE, MILNACIPRAN AND DULOXETINE TO INCREASE AVAILABLE SEROTONIN, NOREPINEPHRINE AND DOPAMINE IN THE BRAIN BY ADMINISTERING OXYALKYLAMINE DERIVATIVES ELI LILLY AND COMPANY (US) 1996-07-02 US disclosed
US-5532250-A ADMINISTERING A SEROTONIN 1A RECEPTOR ANTAGONIST: ALPRENOLOL, PINDOLOL, PROPRANOLOL, OR TERTATOLOL, WITH FLUOXETINE, VENLAFAXINE, MILNACIPRAN RO DULOXETINE ELI LILLY AND COMPANY (US) 1996-07-02 US disclosed
US-5532244-A Potentiation of drug response ELI LILLY AND COMPANY (US) 1996-07-02 US disclosed
US-5532268-A INCREASING THE SEROTONIN, NOREPINEPHRINE AND DOPAMINE IN THE BRAIN USING FLUOXETINE AND ALPRENOLOL, SPIPERONE, TETRATOLOL AND PROPRANOLOL ELI LILLY AND COMPANY (US) 1996-07-02 US disclosed
EP-0714663-A2 Potentiation of drug response by a serotonin 1A receptor antagonist ELI LILLY AND COMPANY (US) 1996-06-05 EP disclosed
EP-0687472-A2 Potentiation of drug response by a serotonin 1A receptor antagonist ELI LILLY AND COMPANY (US) 1995-12-20 EP disclosed
EP-0642787-A2 Cessation of tobacco use ELI LILLY AND COMPANY (US) 1995-03-15 EP disclosed