SCHEMBL4145807

SCHEMBL4145807

Cc1cccc([C@](O)(C(=O)N(C)C[C@H]2[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c2ccccc2)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 2/20 0.40
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
BCHE P06276 3/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
FAAH O00519 1/20 0.39
DCUN1D1 Q96GG9 1/20 0.38
ACHE P22303 2/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
S1PR1 P21453 1/20 0.38
GRK5 P34947 1/20 0.38
CDK8 P49336 1/20 0.38
S1PR5 Q9H228 1/20 0.38
CCR2 P41597 1/20 0.38

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
SCHEMBL4619318 0.92 CHRM3 (0.44) CHRM3BCHEKDM4EACHES1PR1
SCHEMBL4143610 0.91 HRH1 (0.43) CHRM3CHRM2CHRM1BCHEACHE
SCHEMBL4137463 0.86 CACNA1G (0.42) CHRM3ACHE
SCHEMBL4619338 0.83 CHRM3 (0.38) CHRM3CHRM2CHRM1BCHEACHE
SCHEMBL4618122 0.83 CHRM3 (0.40) CHRM3CHRM2CHRM1BCHEKDM4E
SCHEMBL4140154 0.82 ACHE (0.42) CHRM3BCHEKDM4EACHES1PR1
SCHEMBL4620168 0.81 CHRM3 (0.41) CHRM3CHRM2CHRM1BCHEALDH1A1
SCHEMBL5093162 0.81 CHRM3 (0.45) CHRM3CHRM2CHRM1BCHEKDM4E
SCHEMBL4128643 0.81 CHRM3 (0.45) CHRM3CHRM2CHRM1BCHEKDM4E
SCHEMBL4619946 0.81 ACHE (0.43) CHRM3CHRM2CHRM1BCHEKDM4E

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-20090221664-A1 PHARMACEUTICAL COMPOSITIONS OF MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2009-09-03 US claimed
US-7446123-B2 Azabicyclo derivatives as muscarinic receptor antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-11-04 US claimed
US-20060287380-A1 Azabicyclo Derivatives as Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2006-12-21 US claimed
US-20090221664-A1 PHARMACEUTICAL COMPOSITIONS OF MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2009-09-03 US disclosed
US-7446123-B2 Azabicyclo derivatives as muscarinic receptor antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-11-04 US disclosed
US-20060287380-A1 Azabicyclo Derivatives as Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2006-12-21 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 (2 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-20090221664-A1 PHARMACEUTICAL COMPOSITIONS OF MUSCARINIC RECEPTOR ANTAGONISTS ADRB2, ADRB1, ADRA2C CHRM3 6/4885CHRM2 9/4885CHRM1 27/4885
US-20060287380-A1 Azabicyclo Derivatives as Muscarinic Receptor Antagonists CHRM3, CHRM2, CHRM5 CHRM3 1/4885CHRM2 2/4885CHRM1 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.