SCHEMBL9028508

SCHEMBL9028508

CN1C2CCC1CC(NC(=O)c1cn(Cc3ccccc3)c3ccccc3c1=O)C2

nearest known ligand 0.73

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.73
CNR1 P21554 2/20 0.73
HTR3A P46098 10/20 0.57
HTR3E A5X5Y0 4/20 0.57
HTR3B O95264 4/20 0.57
HTR3D Q70Z44 4/20 0.57
HTR3C Q8WXA8 4/20 0.57
LMNA P02545 1/20 0.57

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
SCHEMBL9028063 0.89 HTR3A (0.61) CNR2CNR1HTR3AHTR3EHTR3B
SCHEMBL9027144 0.88 HTR3A (0.66) CNR2CNR1HTR3AHTR3EHTR3B
SCHEMBL22416267 0.87 HTR3A (0.58) CNR2CNR1HTR3AHTR3EHTR3B
SCHEMBL16692891 0.87 HTR3A (0.58) CNR2CNR1HTR3AHTR3EHTR3B
SCHEMBL9027739 0.87 HTR3A (0.58) CNR2CNR1HTR3AHTR3EHTR3B
SCHEMBL9027450 0.86 HTR3A (0.67) CNR2CNR1HTR3AHTR3EHTR3B
SCHEMBL9027784 0.86 HTR3A (0.59) CNR2CNR1HTR3AHTR3EHTR3B
SCHEMBL16378030 0.85 CNR1 (0.57) CNR2CNR1HTR3AHTR3EHTR3B
SCHEMBL22416052 0.85 CNR1 (0.57) CNR2CNR1HTR3AHTR3EHTR3B
SCHEMBL9027809 0.85 HTR3A (0.60) CNR2CNR1HTR3AHTR3EHTR3B

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
EP-0494978-B1 HETEROCYCLIC COMPOUNDS WYETH JOHN & BROTHER LTD (GB) 1996-02-28 EP claimed
US-5096901-A PHARMACOLOGICALLY ACTIVE AMIDES AND ESTERS CONTAINING AN AZABICYCLOALKANE MOIETY JOHN WYETH & BROTHER LIMITED (GB) 1992-03-17 US claimed
EP-0494978-B1 HETEROCYCLIC COMPOUNDS WYETH JOHN & BROTHER LTD (GB) 1996-02-28 EP disclosed
US-5362734-A Certain benzo-quinolizine compounds and derivatives thereof AMERICAN HOME PRODUCTS CORPORATION (US) 1994-11-08 US disclosed
US-5225419-A Antagonist 5-hydroxytryptamine for treatment of nausea or vomiting JOHN WYETH & BROTHER, LIMITED (GB) 1993-07-06 US disclosed
EP-0494978-A1 HETEROCYCLIC COMPOUNDS. WYETH JOHN & BROTHER LTD (GB) 1992-07-22 EP disclosed
US-5096901-A PHARMACOLOGICALLY ACTIVE AMIDES AND ESTERS CONTAINING AN AZABICYCLOALKANE MOIETY JOHN WYETH & BROTHER LIMITED (GB) 1992-03-17 US disclosed
WO-1991005783-A1 HETEROCYCLIC COMPOUNDS JOHN WYETH & BROTHER LIMITED (GB) 1991-05-02 WO disclosed