SCHEMBL4244157

SCHEMBL4244157

O=C(c1ccccc1)c1ccccc1N(CC1C2CCC1CN(Cc1ccccc1)C2)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 3/20 0.41
CHRM2 P08172 5/20 0.41
CHRM3 P20309 5/20 0.41
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
S1PR1 P21453 1/20 0.38
S1PR5 Q9H228 1/20 0.38
ACHE P22303 1/20 0.38

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
SCHEMBL4249818 0.93 GAA (0.41) GRIN2BCHRM2CHRM3OPRM1OPRD1
SCHEMBL4244127 0.88 KMT2A (0.45) GRIN2BCHRM2CHRM3ACHE
SCHEMBL4249836 0.84 GRIN2B (0.40) GRIN2BCHRM2CHRM3S1PR1S1PR5
SCHEMBL4238209 0.80 PKM (0.42) CHRM2CHRM3S1PR1S1PR5ACHE
SCHEMBL4248188 0.79 ACHE (0.42) CHRM2CHRM3NPSR1S1PR1S1PR5
SCHEMBL4248181 0.79 ACHE (0.38) GRIN2BS1PR1S1PR5ACHE
SCHEMBL4237568 0.79 KDM4E (0.42) GRIN2BCHRM2CHRM3OPRM1
SCHEMBL4240892 0.79 SIGMAR1 (0.42) GRIN2BACHE
SCHEMBL4241455 0.77 SIGMAR1 (0.41) GRIN2BS1PR1S1PR5ACHE
SCHEMBL4238450 0.77 MEN1 (0.41) GRIN2BACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090012116-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2009-01-08 US claimed
US-20090012116-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2009-01-08 US disclosed
EP-1904446-A2 AZABICYCLO DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2008-04-02 EP disclosed
WO-2007007282-A2 AZABICYCLO DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2007-01-18 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-20090012116-A1 Muscarinic Receptor Antagonists CHRM3, CHRM2, CHRM5 GRIN2B 421/4885CHRM2 2/4885CHRM3 1/4885

“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.