SCHEMBL8938201

SCHEMBL8938201

Oc1ccccc1CCN1CCCCC1OC(c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.53
CHRM2 P08172 1/20 0.40
HTR1A P08908 1/20 0.40
ADRA2A P08913 1/20 0.40
CYP2D6 P10635 1/20 0.40
CHRM1 P11229 1/20 0.40
DRD1 P21728 1/20 0.40
SLC6A2 P23975 1/20 0.40
ADRA1A P35348 1/20 0.40
OPRM1 P35372 1/20 0.40
DRD3 P35462 1/20 0.40
SLC6A3 Q01959 1/20 0.40
KCNH2 Q12809 1/20 0.40
MAPK1 P28482 1/20 0.39
SLC2A1 P11166 1/20 0.39

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
SCHEMBL8938460 0.84 HRH3 (0.58) HRH3KCNH2
SCHEMBL8938514 0.83 HRH3 (0.42) HRH3
SCHEMBL8938361 0.81 GBA1 (0.41) HRH3CHRM2HTR1AADRA2ACYP2D6
SCHEMBL8938354 0.81 OPRM1 (0.43) OPRM1
SCHEMBL8938542 0.79 HRH3 (0.49) HRH3CHRM2HTR1AADRA2ACYP2D6
SCHEMBL8938621 0.79 SIGMAR1 (0.41) HRH3CHRM2HTR1AADRA2ACYP2D6
SCHEMBL8938226 0.79 HRH3 (0.40) HRH3CHRM2HTR1AADRA2ACYP2D6
SCHEMBL8938364 0.78 KDM4E (0.41) HRH3CHRM2HTR1AADRA2ACYP2D6
SCHEMBL8938454 0.78 HRH3 (0.54) HRH3CHRM2HTR1AADRA2ACYP2D6
SCHEMBL8938558 0.78 HRH3 (0.52) HRH3CHRM2HTR1AADRA2ACYP2D6

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