SCHEMBL1018366

SCHEMBL1018366

CC(=O)Nc1ccccc1C#Cc1ccc(OC2CN3CCC2CC3)nn1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.42
ATM Q13315 1/20 0.42
CHRM3 P20309 2/20 0.41
CHRM2 P08172 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRNA7 P36544 3/20 0.41
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
ALDH1A1 P00352 1/20 0.37
OGA O60502 1/20 0.37
CYP2D6 P10635 1/20 0.37

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
SCHEMBL3080514 0.84 RAB9A (0.44) CHRM2CHRNA7BCHEACHEALDH1A1
SCHEMBL1017423 0.84 RAB9A (0.44) CHRM2CHRNA7BCHEACHEALDH1A1
SCHEMBL3088580 0.84 RAB9A (0.44) CHRM2CHRNA7BCHEACHEALDH1A1
SCHEMBL1018516 0.83 GRM5 (0.45) CHRNA7BCHEACHEALDH1A1OGA
SCHEMBL5624115 0.80 RAB9A (0.39) CHRNA7BCHEACHEALDH1A1OGA
SCHEMBL1018872 0.79 CHRNA7 (0.43) CHRM3CHRM2CHRM1CHRNA7BCHE
SCHEMBL1019028 0.79 CHRNA7 (0.43) CHRM3CHRM2CHRM1CHRNA7BCHE
SCHEMBL1017495 0.79 CHRNA7 (0.43) GAAATMCHRM3CHRM2CHRM1
SCHEMBL3084805 0.78 CHRNA7 (0.46) CHRM3CHRM2CHRM1CHRNA7BCHE
SCHEMBL3088178 0.78 CHRNA7 (0.46) CHRM3CHRM2CHRM1CHRNA7BCHE

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-1802616-B1 NOVEL AZABICYCLIC ARYL DERIVATIVES AND THEIR MEDICAL USE NEUROSEARCH AS (DK) 2011-01-12 EP claimed
US-7652010-B2 Azabicyclic aryl derivatives and their medical use NEUROSEARCH A/S (DK) 2010-01-26 US claimed
US-20070299082-A1 Novel Azabicyclic Aryl Derivatives and Their Medical Use ANIONA APS (DK) 2007-12-27 US claimed
EP-1802616-B1 NOVEL AZABICYCLIC ARYL DERIVATIVES AND THEIR MEDICAL USE NEUROSEARCH AS (DK) 2011-01-12 EP disclosed
US-7652010-B2 Azabicyclic aryl derivatives and their medical use NEUROSEARCH A/S (DK) 2010-01-26 US disclosed
US-20070299082-A1 Novel Azabicyclic Aryl Derivatives and Their Medical Use ANIONA APS (DK) 2007-12-27 US 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-20070299082-A1 Novel Azabicyclic Aryl Derivatives and Their Medical Use CHRNA6, CHRNA10, CHRNA5 GAA 1646/4885ATM 2796/4885CHRM3 17/4885

“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.