SCHEMBL2990786

SCHEMBL2990786

O=C(C1CCOCC1)C1CC2CNCC(C2)C1

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNA4 P43681 17/20 0.75
CHRNB2 P17787 16/20 0.75
CHRNB4 P30926 13/20 0.75
CHRNA3 P32297 13/20 0.75
CHRNA7 P36544 11/20 0.50

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
SCHEMBL2990358 0.86 CHRNB2 (1.00) CHRNA4CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL2991700 0.83 CHRNB2 (0.74) CHRNA4CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL2996401 0.82 CHRNB2 (0.84) CHRNA4CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL2992177 0.82 CHRNB2 (0.84) CHRNA4CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL2987206 0.81 CHRNB2 (0.81) CHRNA4CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL28686853 0.77 CHRNB2 (0.37) CHRNA4CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL15130168 0.75 CHRNB2 (0.41) CHRNA4CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL2983035 0.71 CHRNB2 (0.50) CHRNA4CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL2988240 0.69 CHRNB2 (0.61) CHRNA4CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL2984779 0.67 CHRNB2 (0.59) CHRNA4CHRNB2CHRNB4CHRNA3CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2139857-A1 SUB-TYPE SELECTIVE AZABICYCLOALKANE DERIVATIVES Targacept Inc. (US) 2010-01-06 EP claimed
WO-2008121686-A1 SUB-TYPE SELECTIVE AZABICYCLOALKANE DERIVATIVES TARGACEPT, INC. (US) 2008-10-09 WO claimed
US-8198296-B2 Sub-type selective azabicycloalkane derivatives TARGACEPT, INC. (US) 2012-06-12 US disclosed
US-20100173968-A1 SUB-TYPE SELECTIVE AZABICYCLOALKANE DERIVATIVES TARGACEPT, INC. (US) 2010-07-08 US disclosed
EP-2139857-A1 SUB-TYPE SELECTIVE AZABICYCLOALKANE DERIVATIVES Targacept Inc. (US) 2010-01-06 EP disclosed
WO-2008121686-A1 SUB-TYPE SELECTIVE AZABICYCLOALKANE DERIVATIVES TARGACEPT, INC. (US) 2008-10-09 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100173968-A1 SUB-TYPE SELECTIVE AZABICYCLOALKANE DERIVATIVES CHRNB2, CHRNB4, CHRNA4 CHRNA4 3/4885CHRNB2 1/4885CHRNB4 2/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.