SCHEMBL8072071

SCHEMBL8072071

CN1C2C=CC(C2)C1c1cncc(Br)c1

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 4/20 0.38
CHRNA4 P43681 4/20 0.38

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
SCHEMBL8070733 0.75 CHRNB2 (0.46) CHRNB2CHRNA4
SCHEMBL8484697 0.70 CHRNB2 (0.39) CHRNB2CHRNA4
SCHEMBL27585149 0.64 CHRNB2 (0.41) CHRNB2CHRNA4
SCHEMBL31014511 0.63 CYP11B2 (0.46) CHRNB2CHRNA4
SCHEMBL29845299 0.62 POLB (0.38) CHRNB2CHRNA4
SCHEMBL1426303 0.62 POLB (0.38) CHRNB2CHRNA4
SCHEMBL30116774 0.62 CHRNA7 (0.46) CHRNB2CHRNA4
SCHEMBL8076992 0.62 CHRNA7 (0.46) CHRNB2CHRNA4
SCHEMBL3058809 0.62 CHRNB2 (0.62) CHRNB2CHRNA4
SCHEMBL3058805 0.62 CHRNB2 (0.62) CHRNB2CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6100269-A ADMINISTERING TO PATIENT NICOTINIC RECEPTOR AGONISTIC DERIVATIVES OF 3-(PYRIDYL OR PYRIMIDYL)-2-AZABICYCLO(2.2.1) HEPTANE OR 2-AZABICYCLO(2.2.2.)OCTANE TO ELICIT NEUROTRANSMITTER SECRETION WITH REDUCED SIDE EFFECTS BENCHERIF MEROUANE (US) 2000-08-08 US disclosed
US-5583140-A ADMINISTERING 2-AZABICYCLO(2.2.2)OCT-5-ENE DERIVATIVES TO TREAT NEURODEGENERATIVE DISORDERS SUCH AS SENILE DEMENTIA OF ALZHEIMER'S TYPE TARGACEPT, INC. A CORP. OF DE, 1996-12-10 US disclosed
WO-1996036637-A1 PHARMACEUTICAL COMPOSITIONS FOR PREVENTION AND TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS R.J. REYNOLDS TOBACCO COMPANY (US) 1996-11-21 WO disclosed