SCHEMBL28976466

SCHEMBL28976466

Cc1nnc(C)c(C2CCC(F)(F)CC2)c1C(N)=O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 4/20 0.33
▸ PARP2 Q9UGN5 2/20 0.32
▸ KDM1A O60341 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ SCN10A Q9Y5Y9 1/20 0.32
▸ OPRM1 P35372 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
SCHEMBL28976746 0.86 POLB (0.33) OPRM1
SCHEMBL28976932 0.80 KDM1A (0.39) PARP1PARP2KDM1AMAOBSCN10A
SCHEMBL28976385 0.79 KDM1A (0.38) PARP1PARP2KDM1AMAOBSCN10A
SCHEMBL28976390 0.78 KDM1A (0.38) PARP1PARP2KDM1AMAOBSCN10A
SCHEMBL28976619 0.77 KDM1A (0.37) PARP1PARP2KDM1AMAOBSCN10A
SCHEMBL28976422 0.76 KDM1A (0.36) PARP1KDM1AMAOBSCN10AOPRM1
SCHEMBL28976512 0.74 IRAK4 (0.35) KDM1AMAOB
SCHEMBL28976927 0.74 PARP1 (0.33) PARP1PARP2KDM1AMAOBSCN10A
SCHEMBL28974169 0.72 KDM1A (0.36) PARP1PARP2KDM1AMAOBOPRM1
SCHEMBL28976950 0.71 KDM1A (0.41) PARP1PARP2KDM1AMAOBSCN10A

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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