SCHEMBL5116052

SCHEMBL5116052

O=C(C[C@@H]1CCN(Cc2ccccc2)C1)Oc1cccc(C2CCCC2)c1O

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.51
DRD4 P21917 2/20 0.51
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CHRM4 P08173 1/20 0.44
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
MAOB P27338 1/20 0.41
LTA4H P09960 2/20 0.41
SCN4A P35499 2/20 0.40

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
SCHEMBL5115681 0.84 TACR3 (0.52) DRD2DRD4
SCHEMBL6180467 0.81 CHRM2 (0.37) DRD2DRD4LTA4H
SCHEMBL3205171 0.78 PTGDR2 (0.39) MEN1KMT2ACHRM4BCHE
SCHEMBL4889901 0.75 PTGDR2 (0.38) DRD2DRD4MEN1KMT2ABCHE
SCHEMBL8446486 0.74 LTA4H (0.65) DRD2DRD4BCHEACHEMAOB
SCHEMBL5116054 0.74 BCHE (0.47) MEN1KMT2ABCHEACHEMAOB
SCHEMBL5145288 0.73 SLC6A2 (0.40)
SCHEMBL7695896 0.72 LTA4H (0.65) BCHEACHELTA4H
SCHEMBL9631914 0.72 BCHE (0.54) DRD2DRD4BCHEACHELTA4H
SCHEMBL23182609 0.70 ACHE (0.56) BCHEACHESCN4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060194862-A1 1-Substituted-3-pyrrolidine derivatives as muscarinic receptor antagonists RANBAXY LABORATORIES LIMITED (IN) 2006-08-31 US claimed
US-7465751-B2 1-substituted-3-pyrrolidine derivatives as muscarinic receptor antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-12-16 US disclosed
US-20060194862-A1 1-Substituted-3-pyrrolidine derivatives as muscarinic receptor antagonists RANBAXY LABORATORIES LIMITED (IN) 2006-08-31 US disclosed
EP-1583741-A1 1-SUBSTITUTED-3-PYRROLIDINE DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories, Limited (IN) 2005-10-12 EP disclosed
WO-2004056767-A1 1-SUBSTITUTED-3-PYRROLIDINE DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2004-07-08 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-20060194862-A1 1-Substituted-3-pyrrolidine derivatives as muscarinic receptor antagonists CHRM3, CHRM1, CHRM5 DRD2 233/4885DRD4 426/4885MEN1 1478/4885

“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.