SCHEMBL28976932

SCHEMBL28976932

Cc1cnc(C)c(C(N)=O)c1C1CCC(F)(F)CC1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 2/20 0.39
▸ MAOB P27338 2/20 0.39
▸ SCN10A Q9Y5Y9 1/20 0.34
▸ CCR5 P51681 3/20 0.33
▸ LNPEP Q9UIQ6 1/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ PARP1 P09874 4/20 0.33
▸ PARP2 Q9UGN5 2/20 0.32
▸ MAPK8 P45983 1/20 0.32
▸ MAPK3 P27361 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ SYK P43405 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ AURKB Q96GD4 1/20 0.32
▸ PKMYT1 Q99640 1/20 0.32
▸ DGAT1 O75907 4/20 0.32
▸ SOAT1 P35610 1/20 0.31
▸ CAMK1D Q8IU85 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
SCHEMBL28976385 0.88 KDM1A (0.38) KDM1AMAOBSCN10ACCR5OPRM1
SCHEMBL28976390 0.87 KDM1A (0.38) KDM1AMAOBSCN10ACCR5LNPEP
SCHEMBL28976619 0.86 KDM1A (0.37) KDM1AMAOBSCN10ACCR5LNPEP
SCHEMBL28976422 0.85 KDM1A (0.36) KDM1AMAOBSCN10AOPRM1PARP1
SCHEMBL28976512 0.83 IRAK4 (0.35) KDM1AMAOB
SCHEMBL28976327 0.81 KDM1A (0.41) KDM1AMAOBSCN10ACCR5LNPEP
SCHEMBL28976466 0.80 PARP1 (0.33) KDM1AMAOBSCN10AOPRM1PARP1
SCHEMBL28976950 0.78 KDM1A (0.41) KDM1AMAOBSCN10ALNPEPOPRM1
SCHEMBL28976710 0.77 KDM1A (0.41) KDM1AMAOBSCN10ALNPEPOPRM1
SCHEMBL28976746 0.74 POLB (0.33) OPRM1

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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