SCHEMBL9563272

SCHEMBL9563272

CS(=O)(=O)Nc1ccc(F)cc1OCCCN1CCC(OC(c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 9/20 0.53
PARP14 Q460N5 1/20 0.47
HTR1A P08908 6/20 0.46
HTR7 P34969 4/20 0.46
CHRM3 P20309 2/20 0.45
DRD2 P14416 3/20 0.45
HTR6 P50406 3/20 0.45
HTR2A P28223 2/20 0.45
CHRM2 P08172 2/20 0.44
ADRA2A P08913 2/20 0.44
CHRM1 P11229 2/20 0.44
DRD1 P21728 2/20 0.44
SLC6A2 P23975 2/20 0.44
ADRA1A P35348 2/20 0.44
DRD3 P35462 2/20 0.44
SLC6A3 Q01959 2/20 0.44
KCNH2 Q12809 2/20 0.44
NPC1 O15118 1/20 0.44
MLNR O43193 1/20 0.44
NR1I2 O75469 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
SCHEMBL9563263 0.91 BCHE (0.52) BCHEPARP14HTR1ACHRM3DRD2
SCHEMBL9563308 0.90 BCHE (0.48) BCHEPARP14HTR1ACHRM3DRD2
SCHEMBL9563241 0.90 BCHE (0.53) BCHEPARP14HTR1AHTR7CHRM3
Hydrochloric Acid SCHEMBL9563254 0.90 BCHE (0.51) BCHEPARP14HTR1ACHRM3DRD2
SCHEMBL9563179 0.88 BCHE (0.56) BCHEPARP14HTR1ACHRM3DRD2
SCHEMBL9563339 0.87 BCHE (0.55) BCHEPARP14HTR1ACHRM3DRD2
SCHEMBL9563184 0.86 BCHE (0.48) BCHEPARP14HTR1ACHRM3DRD2
SCHEMBL9563285 0.86 BCHE (0.46) BCHEPARP14HTR1ACHRM3DRD2
SCHEMBL9563225 0.86 HTR1A (0.48) BCHEPARP14HTR1AHTR7CHRM3
SCHEMBL9563309 0.86 BCHE (0.55) BCHEPARP14HTR1ACHRM3DRD2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0529365-A1 Diarylmethoxypiperidine derivatives Kaken Pharmaceutical Co., Ltd. (JP) 1993-03-03 EP disclosed
US-5190959-A Antihistamines, antiallergens, treatment of ischemic heart disease KAKEN PHARMACEUTICAL CO. LTD. (JP) 1993-03-02 US disclosed