SCHEMBL4620934

SCHEMBL4620934

Cc1ccc(C(O)(C(=O)OCC2C3CNCC32)c2ccc(C)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 5/20 0.38
ALDH1A1 P00352 1/20 0.36
KCNH2 Q12809 1/20 0.36
CHRM2 P08172 4/20 0.35
CHRM1 P11229 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
POLB P06746 1/20 0.35
ALPL P05186 1/20 0.34
PTBP1 P26599 1/20 0.34
CHRM4 P08173 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
SSTR4 P31391 4/20 0.34
CHRM5 P08912 1/20 0.33
CYP2D6 P10635 1/20 0.33

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
SCHEMBL4878736 0.84 LMNA (0.43) CHRM3ALDH1A1CHRM2CHRM1MEN1
SCHEMBL3216742 0.82 CHRM3 (0.46) CHRM3ALDH1A1KCNH2CHRM2CHRM1
SCHEMBL4619098 0.76 ALPL (0.36) ALDH1A1KCNH2ALPLPTBP1SSTR4
SCHEMBL4131231 0.75 ALDH1A1 (0.44) ALDH1A1MEN1KMT2APOLBALPL
SCHEMBL4131229 0.75 ALDH1A1 (0.44) ALDH1A1MEN1KMT2APOLBALPL
SCHEMBL4191418 0.74 CHRM3 (0.51) CHRM3ALDH1A1KCNH2CHRM2CHRM1
SCHEMBL3213540 0.74 CHRM3 (0.46) CHRM3ALDH1A1KCNH2CHRM2CHRM1
SCHEMBL4617611 0.73 SSTR4 (0.42) CHRM3KCNH2CHRM2CHRM1MEN1
SCHEMBL3210034 0.72 CHRM2 (0.49) CHRM3ALDH1A1KCNH2CHRM2CHRM1
SCHEMBL4190777 0.72 LMNA (0.41) CHRM3ALDH1A1KCNH2CHRM2CHRM1

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 CHRM3 1/4885ALDH1A1 1047/4885KCNH2 766/4885

“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.