SCHEMBL4725862

SCHEMBL4725862

O=C1NCc2ccc(OCCCN3CCN(c4cccc5cccc(F)c45)CC3)cc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 20/20 1.00
HTR2A P28223 20/20 1.00
HTR1A P08908 17/20 1.00
KCNH2 Q12809 9/20 1.00
SLC6A4 P31645 10/20 0.95

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
SCHEMBL4730200 0.97 DRD2 (1.00) DRD2HTR2AHTR1AKCNH2SLC6A4
SCHEMBL4725837 0.90 DRD2 (0.87) DRD2HTR2AHTR1AKCNH2SLC6A4
SCHEMBL4728119 0.88 DRD2 (1.00) DRD2HTR2AHTR1AKCNH2SLC6A4
SCHEMBL4729111 0.87 DRD2 (1.00) DRD2HTR2AHTR1AKCNH2SLC6A4
SCHEMBL4728142 0.86 DRD2 (1.00) DRD2HTR2AHTR1AKCNH2SLC6A4
SCHEMBL4784191 0.86 HTR1A (1.00) DRD2HTR2AHTR1AKCNH2SLC6A4
SCHEMBL4729261 0.86 HTR1A (1.00) DRD2HTR2AHTR1AKCNH2SLC6A4
SCHEMBL4729095 0.86 DRD2 (1.00) DRD2HTR2AHTR1AKCNH2SLC6A4
SCHEMBL4726939 0.85 DRD2 (1.00) DRD2HTR2AHTR1AKCNH2SLC6A4
SCHEMBL4725801 0.83 HTR1A (1.00) DRD2HTR2AHTR1AKCNH2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008020306-A2 ISOINDOLE DERIVATIVES PFIZER PRODUCTS INC. (US) 2008-02-21 WO claimed