SCHEMBL3073508

SCHEMBL3073508

COc1ccc(C#Cc2ccc(O[C@@H]3CN4CCC3CC4)nn2)cc1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.43
LSS P48449 1/20 0.39
CHRM2 P08172 1/20 0.37
CHRM1 P11229 1/20 0.37
MCHR1 Q99705 1/20 0.37
GRM3 Q14832 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
SCHEMBL3085002 1.00 CHRNA7 (0.43) CHRNA7LSSCHRM2CHRM1MCHR1
SCHEMBL1020348 1.00 CHRNA7 (0.43) CHRNA7LSSCHRM2CHRM1MCHR1
SCHEMBL1018315 0.91 CHRNA7 (0.44) CHRNA7LSS
SCHEMBL1019569 0.90 CHRNA7 (0.44) CHRNA7LSS
SCHEMBL1017804 0.86 CHRNA7 (0.44) CHRNA7LSSCHRM2CHRM1
SCHEMBL1019786 0.86 CHRNA7 (0.44) CHRNA7LSSCHRM2CHRM1
SCHEMBL3065850 0.86 CHRNA7 (0.44) CHRNA7LSSCHRM2CHRM1
SCHEMBL1018510 0.86 LSS (0.48) CHRNA7LSSCHRM2CHRM1MCHR1
SCHEMBL3080565 0.86 CHRNA7 (0.44) CHRNA7LSSCHRM2CHRM1
SCHEMBL3084805 0.86 CHRNA7 (0.46) CHRNA7CHRM2CHRM1

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
US-20100227869-A1 ENANTIOPURE QUINUCLIDINYLOXY PYRIDAZINES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS NEUROSEARCH A/S (DK) 2010-09-09 US claimed
EP-1987029-B1 ENANTIOPURE QUINUCLIDINYLOXY PYRIDAZINES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS NEUROSEARCH AS (DK) 2010-01-13 EP claimed
EP-1987029-A1 ENANTIOPURE QUINUCLIDINYLOXY PYRIDAZINES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS NEUROSEARCH A/S (DK) 2008-11-05 EP claimed
WO-2007093602-A1 ENANTIOPURE QUINUCLIDINYLOXY PYRIDAZINES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS NEUROSEARCH A/S (DK) 2007-08-23 WO claimed
US-20100227869-A1 ENANTIOPURE QUINUCLIDINYLOXY PYRIDAZINES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS NEUROSEARCH A/S (DK) 2010-09-09 US disclosed
EP-1987029-B1 ENANTIOPURE QUINUCLIDINYLOXY PYRIDAZINES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS NEUROSEARCH AS (DK) 2010-01-13 EP disclosed
EP-1987029-A1 ENANTIOPURE QUINUCLIDINYLOXY PYRIDAZINES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS NEUROSEARCH A/S (DK) 2008-11-05 EP disclosed
WO-2007093602-A1 ENANTIOPURE QUINUCLIDINYLOXY PYRIDAZINES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS NEUROSEARCH A/S (DK) 2007-08-23 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-20100227869-A1 ENANTIOPURE QUINUCLIDINYLOXY PYRIDAZINES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS CHRNA5, CHRNA6, CHRNA2 CHRNA7 7/4885LSS 2595/4885CHRM2 18/4885

“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.