SCHEMBL8938323

SCHEMBL8938323

c1ccc(C(OC2CCCCN2CCc2ccc3c(c2)CCOO3)c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 4/20 0.36
CHRM2 P08172 3/20 0.36
CHRM5 P08912 3/20 0.36
ADRA2A P08913 2/20 0.36
ADRA1A P35348 2/20 0.36
OPRM1 P35372 2/20 0.36
KCNH2 Q12809 2/20 0.36
CHRM4 P08173 2/20 0.36
CHRM3 P20309 2/20 0.36
ADRB2 P07550 1/20 0.36
ADRB1 P08588 1/20 0.36
DRD2 P14416 1/20 0.36
KCNE1 P15382 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
HRH2 P25021 1/20 0.36
HTR2A P28223 1/20 0.36
SLC6A4 P31645 1/20 0.36
OPRK1 P41145 1/20 0.36
HTR2B P41595 1/20 0.36

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
SCHEMBL8938383 0.91 DRD2 (0.36) KCNH2DRD2HTR2ASLC6A2DRD3
SCHEMBL9542126 0.81 ADRA1D (0.43) ADRA1AOPRM1OPRK1SIGMAR1
SCHEMBL8938319 0.80 SLC6A4 (0.43) CHRM1CHRM2CHRM5ADRA2AADRA1A
SCHEMBL8938514 0.76 HRH3 (0.42) HRH3
SCHEMBL8938226 0.76 HRH3 (0.40) CHRM1CHRM2ADRA2AADRA1AOPRM1
SCHEMBL8938621 0.76 SIGMAR1 (0.41) CHRM1CHRM2ADRA2AADRA1AOPRM1
SCHEMBL8938361 0.76 GBA1 (0.41) CHRM1CHRM2ADRA2AADRA1AOPRM1
SCHEMBL8938348 0.76 HTR2A (0.41) HTR2AHRH3SIGMAR1
SCHEMBL8938195 0.76 SIGMAR1 (0.44) OPRK1HRH3SIGMAR1
SCHEMBL8938354 0.76 OPRM1 (0.43) OPRM1OPRK1

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-5534626-A SELECTIVE MUSCARINIC RECEPTOR ANTAGONIST INTERMEDIATES PFIZER INC. (US) 1996-07-09 US disclosed
US-5410046-A Selective muscarinic receptor antagonists PFIZER INC. (US) 1995-04-25 US disclosed
US-5231104-A Anticholinergic PFIZER INC. (US) 1993-07-27 US disclosed
EP-0350309-B1 PIPERIDINE DERIVATIVES Pfizer Limited (GB) 1992-11-11 EP disclosed
US-5089505-A Anticholinergic agents PFIZER INC. (US) 1992-02-18 US disclosed
EP-0350309-A1 Piperidine derivatives Pfizer Limited (GB) 1990-01-10 EP disclosed