SCHEMBL8411554

SCHEMBL8411554

CC1(C)CC(C(=O)NCCOCCN=C=S)C(C)(C)N1[O]

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 4/20 0.35
NFE2L2 Q16236 4/20 0.35
EPHX2 P34913 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
SCHEMBL2030480 0.88 KEAP1 (0.39) KEAP1NFE2L2
SCHEMBL8670419 0.86 KEAP1 (0.46) KEAP1NFE2L2
SCHEMBL8676534 0.77 GAA (0.31)
SCHEMBL2024876 0.77 KEAP1 (0.40) KEAP1NFE2L2
SCHEMBL28625375 0.76 KEAP1 (0.38) KEAP1NFE2L2
SCHEMBL718641 0.74 MGLL (0.41)
SCHEMBL11803872 0.70 FPR3 (0.35)
SCHEMBL9439471 0.69 CYP3A4 (0.33) EPHX2
SCHEMBL2024934 0.67 CYP3A4 (0.30) EPHX2
SCHEMBL8673309 0.65 OPRM1 (0.34)

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
EP-0327263-B1 Hair growth stimulation with nitroxide and other radicals PROCTOR PETER H (US) 1994-09-07 EP claimed
EP-0929810-A2 HOMOGENOUS LUMINESCENCE ENERGY TRANSFER ASSAYS WALLAC OY (FI) 1999-07-21 EP disclosed
WO-1998015830-A2 HOMOGENOUS LUMINESCENCE ENERGY TRANSFER ASSAYS WALLAC OY (FI) 1998-04-16 WO disclosed
EP-0327263-B1 Hair growth stimulation with nitroxide and other radicals PROCTOR PETER H (US) 1994-09-07 EP disclosed
EP-0327263-A1 Hair growth stimulation with nitroxide and other radicals PROCTOR, Peter H. (US) 1989-08-09 EP disclosed