SCHEMBL24317706

SCHEMBL24317706

CCCN(SC)C1CCN(C)C1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PGR P06401 3/20 0.39
SLC6A2 P23975 2/20 0.35
NCF1 P14598 1/20 0.31
DRD3 P35462 6/20 0.31
BCHE P06276 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 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
SCHEMBL690369 0.77 DRD3 (0.42) PGRDRD3
SCHEMBL13939978 0.76 SIGMAR1 (0.41) PGRSLC6A2NCF1DRD3HTR2A
SCHEMBL24316246 0.75 PGR (0.39) PGRSLC6A2NCF1DRD3HTR2A
SCHEMBL19148902 0.72 ADH1A (0.45)
SCHEMBL19150951 0.71 ADH1A (0.47)
SCHEMBL19226484 0.69 PGR (0.43) PGRSLC6A2BCHEHTR2AHTR2C
SCHEMBL18820340 0.69 PGR (0.39) PGRSLC6A2NCF1HTR2AHTR2C
SCHEMBL81626 0.69 PGR (0.39) PGRSLC6A2NCF1HTR2AHTR2C
SCHEMBL18820341 0.69 PGR (0.39) PGRSLC6A2NCF1HTR2AHTR2C
SCHEMBL688629 0.69 DRD3 (0.45) DRD3

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-2022081927-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY C4 THERAPEUTICS, INC. (US) 2022-04-21 WO disclosed