SCHEMBL9614388

SCHEMBL9614388

CCN1CCN(c2cc(-c3ccc(F)cc3)c3c(n2)C(O)CCCCC3)CC1

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.70
HTR2A P28223 5/20 0.70
KDM4E B2RXH2 6/20 0.39
ALDH1A1 P00352 6/20 0.39
MAPT P10636 4/20 0.39
HTT P42858 1/20 0.39
HRH4 Q9H3N8 1/20 0.37
GAA P10253 4/20 0.36
RAD52 P43351 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KDM2B Q8NHM5 1/20 0.34
LMNA P02545 1/20 0.34

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
Blonanserin SCHEMBL28204389 0.83 DRD2 (0.98) DRD2HTR2AKDM4EALDH1A1MAPT
Blonanserin SCHEMBL119669 0.82 DRD2 (1.00) DRD2HTR2AKDM4EALDH1A1MAPT
Blonanserin SCHEMBL29379647 0.82 DRD2 (1.00) DRD2HTR2AKDM4EALDH1A1MAPT
SCHEMBL7334897 0.82 DRD2 (1.00) DRD2HTR2AKDM4EALDH1A1MAPT
Blonanserin SCHEMBL28331931 0.81 DRD2 (0.98) DRD2HTR2AKDM4EALDH1A1MAPT
SCHEMBL7333157 0.79 DRD2 (0.93) DRD2HTR2AKDM4EALDH1A1MAPT
SCHEMBL10286364 0.76 DRD2 (0.41) DRD2HTR2AKDM4EALDH1A1MAPT
SCHEMBL7332157 0.75 DRD2 (0.57) DRD2HTR2AKDM4EALDH1A1MAPT
SCHEMBL7326283 0.74 DRD2 (0.84) DRD2HTR2AKDM4EALDH1A1MAPT
SCHEMBL7327599 0.74 DRD2 (0.55) DRD2HTR2AKDM4EALDH1A1MAPT

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
JP-4103572-A None JP disclosed
JP-H04103572-A 4-PHENYL-2-(1-PIPERAZINYL)PYRIDINE DERIVATIVE DAINIPPON PHARMACEUT CO LTD 1992-04-06 JP disclosed