SCHEMBL13875520

SCHEMBL13875520

O=C(NCC1C2CCC1CN(Cc1ccccc1)C2)C(O)(c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 3/20 0.46
CHRM2 P08172 2/20 0.44
CHRM1 P11229 2/20 0.44
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
GRIN2B Q13224 1/20 0.42

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
SCHEMBL4189233 0.90 CHRM2 (0.46) CHRM3CHRM2CHRM1
SCHEMBL4189353 0.89 CHRM3 (0.46) CHRM3CHRM2CHRM1
SCHEMBL4190801 0.88 CHRM3 (0.43) CHRM3CHRM2CHRM1GRIN2B
SCHEMBL4188612 0.88 CHRM3 (0.43) CHRM3CHRM2CHRM1GRIN2B
SCHEMBL5105573 0.88 CHRM3 (0.46) CHRM3CHRM2CHRM1CNR1CNR2
SCHEMBL5105568 0.88 CHRM3 (0.46) CHRM3CHRM2CHRM1CNR1CNR2
SCHEMBL4184610 0.85 CHRM2 (0.61) CHRM3CHRM2CHRM1
SCHEMBL4186081 0.84 CHRM3 (0.41) CHRM3CHRM2CHRM1GRIN2B
SCHEMBL4189224 0.83 GRIN2B (0.48) GRIN2B
SCHEMBL5511482 0.83 CHRM3 (0.39) CHRM3CHRM2CHRM1GRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090105221-A1 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2009-04-23 US disclosed
US-20090105221-A1 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2009-04-23 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-20090105221-A1 MUSCARINIC RECEPTOR ANTAGONISTS CHRM3, CHRM5, CHRM2 CHRM3 1/4885CHRM2 3/4885CHRM1 4/4885

“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.