SCHEMBL6420126

SCHEMBL6420126

O=C(Nc1ccccc1Br)OCC1CCN(C(=O)O)CC1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 16/20 0.56
LMNA P02545 1/20 0.53
MAPT P10636 1/20 0.53
BCHE P06276 3/20 0.51
MAOB P27338 2/20 0.51
ACHE P22303 1/20 0.51
CHRM2 P08172 1/20 0.50
CHRM1 P11229 1/20 0.50

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
SCHEMBL6205109 0.84 KDM4E (0.52) CHRM3LMNAMAPT
SCHEMBL17856295 0.84 CHRM3 (0.73) CHRM3
SCHEMBL6664439 0.83 CHRM3 (0.56) CHRM3ACHE
SCHEMBL4014578 0.81 CHRM3 (0.57) CHRM3LMNAMAPTBCHEACHE
SCHEMBL17796970 0.80 CHRM3 (0.53) CHRM3
SCHEMBL17796971 0.80 CHRM3 (0.53) CHRM3
SCHEMBL6419452 0.80 CHRM3 (0.51) CHRM3CHRM2CHRM1
SCHEMBL6663459 0.78 CHRM3 (0.58) CHRM3ACHE
SCHEMBL6421300 0.77 CHRM3 (0.48) CHRM3BCHEMAOBACHECHRM2
SCHEMBL21052153 0.77 CHRM3 (0.76) CHRM3CHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050277676-A1 M3muscarinic acetylcholine receptor antagonists GLAXO GROUP LIMITED (GB) 2005-12-15 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-20050277676-A1 M3muscarinic acetylcholine receptor antagonists CHRM3, CHRM2, CHRM5 CHRM3 1/4885LMNA 3315/4885MAPT 4269/4885

“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.