SCHEMBL1463933

SCHEMBL1463933

CC(C)CC(=O)N1CC2CNCC2C1

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 16/20 0.65
CHRNB4 P30926 16/20 0.65
CHRNA3 P32297 16/20 0.65
CHRNA4 P43681 16/20 0.65
CHRNA7 P36544 14/20 0.65
SMN1; SMN2 Q16637 1/20 0.47
POLB P06746 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL25504806 0.82 SMN1; SMN2 (0.52) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL1463781 0.82 CHRNB2 (0.67) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL20364802 0.79 SMN1; SMN2 (0.48) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL3405917 0.79 CHRNA4 (1.00) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL14222416 0.79 CHRNA4 (1.00) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL1462657 0.79 CHRNA4 (1.00) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL24974012 0.76 SMN1; SMN2 (0.59) CHRNB2CHRNA4SMN1; SMN2POLBNPSR1
SCHEMBL19104799 0.76 SMN1; SMN2 (0.53) SMN1; SMN2POLBNPSR1L3MBTL1
SCHEMBL15490020 0.76 SMN1; SMN2 (0.53) SMN1; SMN2POLBNPSR1L3MBTL1
SCHEMBL17190676 0.76 SMN1; SMN2 (0.53) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7

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
US-20110071180-A1 SUB-TYPE SELECTIVE AMIDES OF DIAZABICYCLOALKANES TARGACEPT, INC. (US) 2011-03-24 US claimed
EP-2257549-A1 NICOTINIC ACETYLCHOLINE RECEPTOR SUB-TYPE SELECTIVE AMIDES OF DIAZABICYCLOAL KANES Targacept Inc. (US) 2010-12-08 EP claimed
WO-2009111550-A1 NICOTINIC ACETYLCHOLINE RECEPTOR SUB-TYPE SELECTIVE AMIDES OF DIAZABICYCLOAL KANES TARGACEPT, INC. (US) 2009-09-11 WO claimed
US-20110071180-A1 SUB-TYPE SELECTIVE AMIDES OF DIAZABICYCLOALKANES TARGACEPT, INC. (US) 2011-03-24 US disclosed
EP-2257549-A1 NICOTINIC ACETYLCHOLINE RECEPTOR SUB-TYPE SELECTIVE AMIDES OF DIAZABICYCLOAL KANES Targacept Inc. (US) 2010-12-08 EP disclosed
WO-2009111550-A1 NICOTINIC ACETYLCHOLINE RECEPTOR SUB-TYPE SELECTIVE AMIDES OF DIAZABICYCLOAL KANES TARGACEPT, INC. (US) 2009-09-11 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-20110071180-A1 SUB-TYPE SELECTIVE AMIDES OF DIAZABICYCLOALKANES CHRNA7, CHRNA2, CHRNA5 CHRNB2 4/4885CHRNB4 9/4885CHRNA3 8/4885

“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.