SCHEMBL8670419

SCHEMBL8670419

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

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 19/20 0.46
NFE2L2 Q16236 19/20 0.46

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 0.92 KEAP1 (0.39) KEAP1NFE2L2
SCHEMBL8411554 0.86 KEAP1 (0.35) KEAP1NFE2L2
SCHEMBL8676534 0.81 GAA (0.31)
SCHEMBL2024876 0.81 KEAP1 (0.40) KEAP1NFE2L2
SCHEMBL11803872 0.79 FPR3 (0.35)
SCHEMBL9439471 0.78 CYP3A4 (0.33)
SCHEMBL28625375 0.78 KEAP1 (0.38) KEAP1NFE2L2
SCHEMBL2024934 0.75 CYP3A4 (0.30)
SCHEMBL8671177 0.72 OPRM1 (0.36)
SCHEMBL21907925 0.69 FPR3 (0.36)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5714510-A Topical proxyl composition and method PROCTOR PETER H (US) 1998-02-03 US claimed
US-5714510-A Topical proxyl composition and method PROCTOR PETER H (US) 1998-02-03 US 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