SCHEMBL23987301

SCHEMBL23987301

Fc1cccc2c1SCCC2

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.39
ADRA2A P08913 2/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
TSHR P16473 1/20 0.36
DRD2 P14416 2/20 0.33
DRD3 P35462 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
NOTUM Q6P988 1/20 0.32
ATM Q13315 1/20 0.32
BCL2L1 Q07817 1/20 0.31
BAD Q92934 1/20 0.31
PDE4B Q07343 1/20 0.30
PDE4D Q08499 1/20 0.30

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
SCHEMBL4104527 0.76 HPGD (0.38) HTR1AADRA2ASLC6A2SLC6A4TSHR
SCHEMBL8581327 0.76 HTR1A (0.41) HTR1AADRA2ASLC6A2SLC6A4TSHR
SCHEMBL7526110 0.76 BCL2L1 (0.48) HTR1AADRA2ASLC6A2SLC6A4TSHR
SCHEMBL23979971 0.76 HTR1A (0.38) HTR1AADRA2ASLC6A2SLC6A4TSHR
SCHEMBL18297576 0.76 HTR1A (0.38) HTR1AADRA2ASLC6A2SLC6A4TSHR
SCHEMBL8901220 0.76 ADRA2A (0.38) HTR1AADRA2ASLC6A2SLC6A4TSHR
SCHEMBL7426602 0.72 ALDH1A1 (0.40) HTR1AADRA2ASLC6A2SLC6A4TSHR
SCHEMBL9409715 0.72 HTR1A (0.41) HTR1AADRA2ASLC6A2SLC6A4TSHR
SCHEMBL13532968 0.72 SLC6A2 (0.41) HTR1AADRA2ASLC6A2SLC6A4TSHR
SCHEMBL14691708 0.72 RYR2 (0.53)

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-2021220170-A1 COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF HIF2-ALPHA AND THEIR METHODS OF USE NOVARTIS AG (CH) 2021-11-04 WO disclosed