SCHEMBL9563188

SCHEMBL9563188

Nc1ccccc1OCCCN1CCC(OC(c2ccc(Cl)cc2)c2ccccn2)CC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 10/20 0.53
BCHE P06276 2/20 0.47
PARP14 Q460N5 1/20 0.44
LMNA P02545 1/20 0.41
CHRM2 P08172 1/20 0.41
ADRA2B P18089 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
HRH1 P35367 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KCNH2 Q12809 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL9563245 0.92 PARP14 (0.51) DRD2BCHEPARP14LMNACHRM2
SCHEMBL9563253 0.88 BCHE (0.59) DRD2BCHEPARP14LMNACHRM2
SCHEMBL9563268 0.85 DRD2 (0.50) DRD2BCHEPARP14CYP2D6CYP2C19
SCHEMBL12090256 0.84 DRD2 (0.49) DRD2BCHELMNACHRM2ADRA2B
SCHEMBL9532269 0.84 DRD2 (0.51) DRD2BCHELMNACHRM2ADRA2B
SCHEMBL9531438 0.83 BCHE (0.53) DRD2BCHELMNACHRM2ADRA2B
SCHEMBL9557473 0.83 DRD2 (0.48) DRD2BCHE
SCHEMBL9532495 0.82 DRD2 (0.51) DRD2BCHELMNACHRM2ADRA2B
SCHEMBL13291278 0.82 BCHE (0.52) DRD2BCHELMNACHRM2ADRA2B
SCHEMBL9563205 0.82 PARP14 (0.58) DRD2BCHEPARP14LMNACHRM2

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