SCHEMBL4199166

SCHEMBL4199166

c1cc(-c2cnc(OC3CN4CCC3CC4)s2)cs1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.45
NTMT1 Q9BV86 1/20 0.44
CHRM1 P11229 5/20 0.38
CHRM2 P08172 2/20 0.37
CHRM3 P20309 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
SCHEMBL3195109 0.84 CHRM1 (0.46) CHRNA7CHRM1CHRM2
SCHEMBL4198260 0.84 USP30 (0.46) CHRNA7CHRM1CHRM2CHRM3
SCHEMBL4205244 0.81 NTMT1 (0.47) CHRNA7NTMT1CHRM1CHRM2CHRM3
SCHEMBL4206234 0.81 CHRM1 (0.45) CHRNA7NTMT1CHRM1CHRM2CHRM3
SCHEMBL3840350 0.80 CHRNA7 (0.44) CHRNA7NTMT1CHRM1CHRM2CHRM3
SCHEMBL3840357 0.80 CHRNA7 (0.44) CHRNA7NTMT1CHRM1CHRM2CHRM3
SCHEMBL4201115 0.80 NTMT1 (0.42) CHRNA7NTMT1CHRM1CHRM2
SCHEMBL4205959 0.79 CHRNA7 (0.43) CHRNA7NTMT1CHRM1CHRM2CHRM3
SCHEMBL17004270 0.76 PRKDC (0.33)
SCHEMBL4202405 0.76 CHRNA7 (0.59) CHRNA7NTMT1CHRM1CHRM2CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090005390-A1 NOVEL QUINUCLIDINE DERIVATIVES AND THEIR USE NEUROSEARCH A/S 2009-01-01 US claimed
EP-1532144-B1 QUINUCLIDINE DERIVATIVES AND THEIR USE NEUROSEARCH AS (DK) 2008-01-23 EP claimed
US-20050245567-A1 Novel quinuclidine derivatives and their use NEUROSEARCH A/S (DK) 2005-11-03 US claimed
EP-1532144-A1 NOVEL QUINUCLIDINE DERIVATIVES AND THEIR USE NEUROSEARCH A/S (DK) 2005-05-25 EP claimed
WO-2004016608-A1 NOVEL QUINUCLIDINE DERIVATIVES AND THEIR USE NEUROSEARCH A/S (DK) 2004-02-26 WO claimed
US-20090005390-A1 NOVEL QUINUCLIDINE DERIVATIVES AND THEIR USE NEUROSEARCH A/S 2009-01-01 US disclosed
EP-1905771-A2 Quinuclidine derivatives and their use NeuroSearch A/S (DK) 2008-04-02 EP disclosed
EP-1532144-B1 QUINUCLIDINE DERIVATIVES AND THEIR USE NEUROSEARCH AS (DK) 2008-01-23 EP disclosed
US-20050245567-A1 Novel quinuclidine derivatives and their use NEUROSEARCH A/S (DK) 2005-11-03 US disclosed
EP-1532144-A1 NOVEL QUINUCLIDINE DERIVATIVES AND THEIR USE NEUROSEARCH A/S (DK) 2005-05-25 EP disclosed
WO-2004016608-A1 NOVEL QUINUCLIDINE DERIVATIVES AND THEIR USE NEUROSEARCH A/S (DK) 2004-02-26 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 (2 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-20090005390-A1 NOVEL QUINUCLIDINE DERIVATIVES AND THEIR USE ACHE, CHRNA5, CHRNA3 CHRNA7 9/4885NTMT1 1796/4885CHRM1 28/4885
US-20050245567-A1 Novel quinuclidine derivatives and their use ACHE, CHRNA5, CHRNA3 CHRNA7 9/4885NTMT1 1796/4885CHRM1 28/4885

“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.