SCHEMBL28976710

SCHEMBL28976710

Cc1ncc(C2CCC(F)(F)CC2)c(C(N)=O)c1F

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 2/20 0.41
▸ MAOB P27338 2/20 0.41
▸ P2RX7 Q99572 3/20 0.33
▸ SCN10A Q9Y5Y9 2/20 0.33
▸ PDE10A Q9Y233 1/20 0.33
▸ CAMK1D Q8IU85 1/20 0.33
▸ PARP1 P09874 1/20 0.32
▸ SCN9A Q15858 2/20 0.32
▸ MAPK8 P45983 1/20 0.32
▸ SCN5A Q14524 1/20 0.32
▸ GCK P35557 1/20 0.31
▸ LNPEP Q9UIQ6 1/20 0.31
▸ OPRM1 P35372 1/20 0.31
▸ ALOX5AP P20292 1/20 0.31
▸ FEN1 P39748 1/20 0.31
▸ CNR2 P34972 1/20 0.31
▸ DGAT1 O75907 2/20 0.31
▸ SOAT1 P35610 1/20 0.31

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
SCHEMBL28976950 0.88 KDM1A (0.41) KDM1AMAOBSCN10APDE10ACAMK1D
SCHEMBL28976327 0.85 KDM1A (0.41) KDM1AMAOBSCN10APDE10ACAMK1D
SCHEMBL28976385 0.79 KDM1A (0.38) KDM1AMAOBP2RX7SCN10ACAMK1D
SCHEMBL28976932 0.77 KDM1A (0.39) KDM1AMAOBSCN10ACAMK1DPARP1
SCHEMBL28976542 0.77 PDE10A (0.37) KDM1AMAOBSCN10APDE10ACAMK1D
SCHEMBL28976373 0.77 PDE10A (0.35) KDM1AMAOBSCN10APDE10ACAMK1D
SCHEMBL28976390 0.75 KDM1A (0.38) KDM1AMAOBP2RX7SCN10ACAMK1D
SCHEMBL28976619 0.74 KDM1A (0.37) KDM1AMAOBP2RX7SCN10APARP1
SCHEMBL28976516 0.73 PARP1 (0.40) KDM1AMAOBPARP1SCN9ASCN5A
SCHEMBL28976466 0.71 PARP1 (0.33) KDM1AMAOBSCN10APARP1OPRM1

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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