SCHEMBL22790885

SCHEMBL22790885

CSNCCOCCOCCOCCn1cc(C)nn1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 4/20 0.33
DPP4 P27487 1/20 0.33
CHRNA7 P36544 2/20 0.32
MAPK14 Q16539 3/20 0.31
DRD2 P14416 5/20 0.31
DRD4 P21917 2/20 0.30
DRD3 P35462 2/20 0.30
BAZ2B Q9UIF8 1/20 0.30
BAZ2A Q9UIF9 1/20 0.30
CYBB P04839 1/20 0.30
NOX5 Q96PH1 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
SCHEMBL18850696 0.84 DPP4 (0.35) NCF1DPP4CHRNA7MAPK14DRD2
SCHEMBL22906473 0.84 DPP4 (0.35) NCF1DPP4CHRNA7MAPK14DRD2
SCHEMBL20180742 0.82 DPP4 (0.34) NCF1DPP4CHRNA7MAPK14DRD2
SCHEMBL25819728 0.82 DPP4 (0.35) NCF1DPP4CHRNA7MAPK14DRD2
SCHEMBL23560142 0.81 DRD2 (0.35) NCF1DPP4CHRNA7MAPK14DRD2
SCHEMBL21106182 0.80 KDM4E (0.37) NCF1DPP4CHRNA7MAPK14
SCHEMBL22856476 0.80 KDM4E (0.37) NCF1DPP4CHRNA7MAPK14
SCHEMBL26464988 0.80 NCF1 (0.33) NCF1DPP4CHRNA7MAPK14DRD2
SCHEMBL23806873 0.80 KDM4E (0.34) NCF1DPP4CHRNA7MAPK14DRD2
SCHEMBL17586038 0.79 CHRNA7 (0.38) NCF1DPP4CHRNA7MAPK14DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023192586-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-10-05 WO disclosed
WO-2021011634-A1 PROTEIN DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2021-01-21 WO disclosed
WO-2020251972-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2020-12-17 WO disclosed
WO-2020251971-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2020-12-17 WO disclosed
WO-2020251969-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2020-12-17 WO disclosed