SCHEMBL4620288

SCHEMBL4620288

COC(C(=O)N(C)CC1C2CNCC21)(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 7/20 0.40
OPRM1 P35372 4/20 0.35
DRD3 P35462 4/20 0.35
DRD4 P21917 1/20 0.35
HTR2C P28335 1/20 0.34
DRD2 P14416 3/20 0.33
USP30 Q70CQ3 1/20 0.33
CES1 P23141 1/20 0.33
SLC6A9 P48067 1/20 0.32
KCNN4 O15554 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL4619797 0.87 OPRM1 (0.43) SSTR4OPRM1DRD3DRD4HTR2C
SCHEMBL30741229 0.83 SSTR4 (0.43) SSTR4OPRM1DRD3DRD4HTR2C
SCHEMBL4619862 0.83 SSTR4 (0.46) SSTR4OPRM1DRD3DRD4HTR2C
SCHEMBL4619277 0.80 ACHE (0.43)
SCHEMBL4620401 0.77 SSTR4 (0.45) SSTR4HTR2CCES1KCNN4
SCHEMBL4617611 0.77 SSTR4 (0.42) SSTR4OPRM1DRD3HTR2CCES1
SCHEMBL4617994 0.76 SSTR4 (0.41) SSTR4OPRM1DRD3DRD4HTR2C
SCHEMBL4619013 0.73 LMNA (0.41) SSTR4HTR2CSLC6A9
SCHEMBL4617833 0.72 SSTR4 (0.41) SSTR4OPRM1
SCHEMBL4619189 0.72 SSTR4 (0.48) SSTR4HTR2CCES1KCNN4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080319043-A1 3,6-Disubstituted Azabicyclo (3.1.0) Hexane Derivatives as Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-12-25 US claimed
EP-1888525-A1 3,6-DISUBSTITUTED AZABICYCLO [3.1.0]HEXANE DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2008-02-20 EP claimed
WO-2006117754-A1 3,6-DISUBSTITUTED AZABICYCLO [3.1.0] HEXANE DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2006-11-09 WO claimed
US-20080319043-A1 3,6-Disubstituted Azabicyclo (3.1.0) Hexane Derivatives as Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-12-25 US disclosed
EP-1888525-A1 3,6-DISUBSTITUTED AZABICYCLO [3.1.0]HEXANE DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2008-02-20 EP disclosed
WO-2006117754-A1 3,6-DISUBSTITUTED AZABICYCLO [3.1.0] HEXANE DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2006-11-09 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-20080319043-A1 3,6-Disubstituted Azabicyclo (3.1.0) Hexane Derivatives as Muscarinic Receptor Antagonists CHRM3, CHRM5, CHRM2 SSTR4 646/4885OPRM1 111/4885DRD3 392/4885

“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.