SCHEMBL8938352

SCHEMBL8938352

CC(=O)Nc1ccc(CCN2CCCC(OC(c3ccccc3)c3ccccc3)C2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 1/20 0.51
GRM5 P41594 1/20 0.50
GRM7 Q14831 1/20 0.50
GRM3 Q14832 1/20 0.50
BCHE P06276 4/20 0.49
MAOB P27338 2/20 0.49
CCR5 P51681 1/20 0.48
SLC6A2 P23975 1/20 0.47
SLC6A4 P31645 1/20 0.47
SLC6A3 Q01959 1/20 0.47
KMT2A Q03164 1/20 0.47
HTR2A P28223 1/20 0.45
KCNH2 Q12809 1/20 0.45
HTR4 Q13639 1/20 0.45
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
CCR2 P41597 1/20 0.44

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
SCHEMBL8938418 0.90 OPRM1 (0.50) DRD3GRM5GRM7GRM3BCHE
SCHEMBL9255555 0.87 GRM5 (0.48) DRD3GRM5GRM7GRM3BCHE
SCHEMBL8938185 0.85 SLC6A2 (0.50) GRM5GRM7GRM3BCHECCR5
SCHEMBL8938288 0.85 SLC6A2 (0.50) GRM5GRM7GRM3BCHECCR5
SCHEMBL8938241 0.84 SLC6A2 (0.45) DRD3GRM5GRM7GRM3BCHE
SCHEMBL8938240 0.84 GRM5 (0.52) DRD3GRM5GRM7GRM3BCHE
SCHEMBL8938637 0.84 SIGMAR1 (0.51) DRD3SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL8938516 0.83 SLC6A2 (0.44) DRD3GRM5GRM7GRM3BCHE
SCHEMBL8938477 0.83 SLC6A2 (0.51) DRD3GRM5GRM7GRM3SLC6A2
SCHEMBL8938360 0.83 SLC6A2 (0.51) DRD3GRM5GRM7GRM3SLC6A2

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