SCHEMBL28976539

SCHEMBL28976539

CCOc1nc(C2CCC(F)(F)CC2)cc(C(N)=O)c1C

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CAMK1D Q8IU85 1/20 0.39
▸ IRAK4 Q9NWZ3 11/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ MAPK8 P45983 2/20 0.33
▸ PARP1 P09874 1/20 0.33
▸ PARP2 Q9UGN5 1/20 0.33
▸ AXL P30530 1/20 0.33

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
SCHEMBL28976371 0.85 CAMK1D (0.39) CAMK1DIRAK4
SCHEMBL28976949 0.83 CAMK1D (0.40) CAMK1DKDM4EMAPK8PARP1PARP2
SCHEMBL28976707 0.77 CAMK1D (0.39) CAMK1DKDM4EMAPK8PARP1PARP2
SCHEMBL28976542 0.74 PDE10A (0.37) CAMK1D
SCHEMBL28976326 0.70 POLB (0.38) CAMK1DPARP1PARP2
SCHEMBL28976616 0.70 SCN10A (0.38) CAMK1DKDM4EMAPK8PARP1PARP2
SCHEMBL31671010 0.70 KDM4E (0.40) NPSR1KDM4EHSD17B10L3MBTL1
SCHEMBL31670983 0.69 KDM4E (0.43) NPSR1KDM4EHSD17B10L3MBTL1
SCHEMBL28976476 0.69 SCN10A (0.41) CAMK1DKDM4EMAPK8PARP1PARP2
SCHEMBL28976931 0.68 SCN10A (0.40) CAMK1DKDM4EMAPK8PARP1PARP2

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
CN-115884810-A Imidazopyridazines as IL-17 modulators 詹森药业有限公司 2023-03-31 — — CN disclosed
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